oral
ORNL/TM-9120
 OAK RIDGE
 NATIONAL
 LABORATORY

                            Environmental Risk Analysis
                            for Indirect Coal Liquefaction

                                     L. W. Barnthouse
                                     G. W. Suter II
                                     C. F. Baes III
                                     S. M. Bartell
                                     M. G. Cavendish
                                     R. H. Gardner
                                     R. V. O'Neill
                                     A. V. Rosen
                                  Environmental Sciences Division
                                     Publication No. 2309
 uPtnATEO BY
 MARTIN MARIETTA ENERGY SYSTEMS, INC.
 FOR THE UNITED STATES
 DEPARTMENT OF ENERGY

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This report was prepared as an account of work sponsored by an agency of the
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endorsement, recommendation, or favoring by the United States Government or
any agency thereof. The views and opinions of authors expressed herein do not
necessarily state or reflect those of the United States Government or any agency
thereof.

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                                                     ORNL/TM-9120

              ENVIRONMENTAL  SCIENCES  DIVISION

ENVIRONMENTAL RISK ANALYSIS FOR INDIRECT COAL LIQUEFACTION


                          Authors

                      L.  W.  Barnthouse1
                      G.  W.  Suter  II1
                      C.  F.  Baes  III
                      S.  M.  Bartell
                      M.  6.  Cavendish
                      R.  H.  Gardner
                      R.  V.  O'Neill
                      A.  E.  Rosen

                   ORNL Project Manager

                      S.  G.  Hildebrand

              Environmental  Sciences  Division
                   Publication No.   2309
Principal Investigators

               Date of Issue - January 1985

                    EPA Project Officer
                      A.  A.  Moghissi

                       Prepared for
            Office of Research and Development
           U.S. Environmental  Protection Agency
                  Washington,  D.C.   20460

        Interagency Agreement No.  DW 8993 0292-01-0
                      (DOE 40-740-78)
                     Prepared by the
              OAK RIDGE NATIONAL LABORATORY
               Oak Ridge, Tennessee  37831
                       operated by
           MARTIN MARIETTA ENERGY  SYSTEMS,  INC.
                          for the
                 U.S. DEPARTMENT OF ENERGY
           under  Contract  No.  DE-AC05-840R21400

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                              DISCLAIMER

Although the research described  in this report has been funded  wholly
or in part by the U. S. Environmental Protection Agency (EPA)  through
Interagency Agreement Number DW  8993 0292-01-0 to the U.S.  Department
of Energy, it has not been subjected to EPA review and therefore does
not necessarily reflect the views of EPA and no official endorsement
should be inferred.

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                           TABLE OF CONTENTS
                                                                    Page
LIST OF FIGURES	    v
LIST OF TABLES	vii
SUMMARY   	   xi
ABSTRACT	   xv
1.  INTRODUCTION  	    1
2.  SOURCE TERMS AND EXPOSURE 	    4
    2.1  Source Terms 	    4
    2.2  Aquatic Exposure Assessment  	    5
         2.2.1  Stream Characteristics  	    5
         2.2.2  Contaminant Characteristics 	    7
         2.2.3  Results	   10
    2.3  Atmospheric Dispersion and Deposition  	   10
3.  AQUATIC ENDPOINTS 	   17
    3.1  Quotient Method	   17
    3.2  Analysis of Extrapolation Error  	   21
         3.2.1  Methods	   22
         3.2.2  Results	   23
         3.2.2  Toxcity of the Whole Effluent	   26
    3.3  Ecosystem Uncertainty Analysis 	   28
         3.3.1  Explanation of Method	   28
         3.3.2  Results of Ecosystem Uncertainty Analysis 	   29
         3.3.3  Comparison of Risks Across RACs	   35
         3.3.4  Comparison of Risks Between Technologies  	   36
4.  TERRESTRIAL ENDPOINTS 	   39
    4.1  Vegetation	   39
    4.2  Wildlife 	 .....   44
5.  EVALUATION OF RISKS	.'   48
    5.1  Evaluation  of Risks to Fish	   48
    5.2  Evaluation  of Risks of Algal Blooms  	   50
    5.3  Evaluation  of Risks to Vegetation and Wildlife  	   50
    5.4  Validation  Needs 	   51
6.  ACKNOWLEDGMENTS	   53

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                                                                   Page
7.   REFERENCES	   54
                                                                  .   69
                                                                  .   83
                                                                  .   97
APPENDIX A.
APPENDIX B.
APPENDIX C.
APPENDIX D.

APPENDIX E.
Aquatic Toxicity Data  	
Terrestrial Toxicity Data  	
Common and Scientific Names of Animals and Plants
             Species-Specific Results of the Analysis
             of Extrapolation Error 	  103
             Detailed Methods and Assumptions for
             Ecosystem Uncertainty Analysis 	  121
             E.I  Organizing Toxicity Data	123
             E.2  Transforming Toxicity Data	124
                  E.2.1  The General Stress Syndrome (6SS)  ....  124
                  E.2.2  The MICROCOSM Simulations	125
                  E.2.3  Choosing Unvertainties	125
                                  IV

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                            LIST OF FIGURES

Figure                                                              Page

3.3.1   Risk estimates for three heavy metals over a
        range of environmental concentrations 	   31

3.3.2   Risk estimates for mercury over a range of
        environmental concentrations  	   32

3.3.3   Risk estimates for ammonia and cadmium over
        a range of environmental concentrations 	   33

3.3.4   Maximum risk estimates for nine RAUs	   37

3.3.5   Comparison of risks between technologies  	   38

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                             LIST OF TABLES

Table                                                               Page

1-1     Risk Analysis Categories (RACs) 	    2

2.1-1   Aqueous source terms (kg/h) for two indirect coal
        liquefaction technologies, control option 1 	    6

2.2-1   Stream characteristics for the eastern reference site ...    8

2.2-2   Contaminant characteristics 	    9

2.2-3   Estimated ambient contaminant concentrations,  eastern
        reference stream, Lurgi/Fischer-Tropsch process  	   11
2.2-4   Estimated ambient contaminant concentrations,  eastern
        reference stream, Koppers-Totzek/Fischer-Tropsch
        process	   12
2.3-1   Maximum ambient atmospheric and soil concentrations
        of RACs for the Lurgi/Fischer-Tropsch process	   15

2.3-2   Maximum ambient atmospheric and soil concentrations
        of RACs for the Koppers-Totzek/Fischer-Tropsch process  . .   16

3.1-1   Toxicity quotients for toxicity to fish and algae
        (ambient contaminant concentration/toxic benchmark
        concentration) for Lurgi/Fischer-Tropsch process  	   19

3.1-2   Toxicity quotients for toxicity to fish and algae
        (ambient contaminant concentration/toxic benchmark
        concentration) for Koppers-Totzek/Fischer-Tropsch
        process	   20

3.2-1   Ranges of predicted geometric means of maximum
        allowable toxicant concentrations (P6MATC):
        ratios of ambient concentrations to PGMATC, and
        probabilities of exceeding the PGMATC for the
        Lurgi/Fischer-Tropsch process 	   24

3.2-2   Ranges of predicted geometric means of maximum
        allowable toxicant concentrations (PGMATC):
        ratios of ambient concentrations to PGMATC, and
        probabilities of exceeding the PGMATC for the
        Koppers-Totzek/Fischer-Tropsch process  	   25

3.2-3   Estimated acute LC5Q for largemouth bass and ratio
        of upper 95th percentile of the ambient concentration
        to the LCso for the Lurgi/Fischer-Tropsch and
        Koppers-Totzek/Fischer-Tropsch processes  	   27

3.3-1   Values of LCcn/ECKQ (mg/L) used to calculate
        effects/matrix for SWACOM  	   30

3.3-2   Deterministic results of EUA	   34

4.1-1   Toxicity quotients for terrestrial plants for the
        Lurgi/Fischer Tropsch process 	   40
                                  VII

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Table                                                               Page
4.1-2   Toxicity quotients for terrestrial plants for the
        Koppers-Totzek/Fischer-Tropsch process  	   41
4.2-1   Toxicity quotients for terrestrial animals for the
        Lurgi/Fischer-Tropsch process 	   45
4.2-2   Toxicity quotients for terrestrial animals for the
        Koppers-Totzek/Fischer-Tropsch process  	   46
5.1-1   RACs determined to pose potentially significant
        risks to fish populations by one or more of three
        risk analysis methods 	   49
A-l     Acute toxicity of synfuels chemicals to aquatic
        animals	   71
A-2     Chronic toxicity of synfuels chemicals to aquatic
        animals	   78
A-3     Toxicity of synfuels chemicals to algae 	   80
B-l     Toxicity of chemicals in air to vascular plants	   85
B-2     Toxicity of chemials in soil or solution to
        vascular plants 	   88
B-3     Toxicity of chemicals in air to animals	   92
D-l     Predicted geometric mean maximum allowable
        toxicant concentrations (PGMATCs) for each RAC
        and each species of fish	105
D-2     Probabilities of chronic toxic effects on fish
        populations due to RAC 4 at annual median ambient
        concentrations for the Lurgi/Fischer-Tropsch process  . .  .  106
D-3     Probabilities of chronic toxic effects on fish
        populations due to RAC 5 at annual median ambient
        concentrations for the Lurgi/Fischer-Tropsch process  . .  .  107
D-4     Probabilities of chronic toxic effects on fish
        populations due to RAC 9 at annual median ambient
        concentrations for the Lurgi/Fischer-Tropsch process  . .  .  108
D-5     Probabilities of chronic toxic effects on fish
        populations due to RAC 31 at annual median ambient
        concentrations for the Lurgi/Fischer-Tropsch process  . .  .  109
D-6     Probabilities of chronic toxic effects on fish
        populations due to RAC 32A at annual median ambient
        concentrations for the Lurgi/Fischer-Tropsch process  . .  .  110
D-7     Probabilities of chronic toxic effects on fish
        populations due to RAC 33 at annual median ambient
        concentrations for the Lurgi/Fischer-Tropsch process  ...  Ill
D-8     Probabilities of chronic toxic effects on fish
        populations due to RAC 34 at annual median ambient
        concentrations for the Lurgi/Fischer-Tropsch process  ...  112
                                  vm

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Table                                                               Page

D-9     Probabilities of chronic toxic effects on fish
        populations due to RAC 35 at annual median ambient
        concentrations for the Lurgi/Fischer-Tropsch process  .  .  .   113
D-10    Probabilities of chronic toxic effects on
        fish populations due to RAC 4 at annual
        median ambient concentrations for the
        Koppers-Totzek/Fischer-Tropsch process  	   114

D-ll    Probabilities of chronic toxic effects on
        fish populations due to RAC 5 at annual
        median ambient concentrations for the
        Koppers-Totzek/Fischer-Tropsch process  	   115

D-12    Probabilities of chronic toxic effects on
        fish populations due to RAC 9 at annual
        median ambient concentrations for the
        Koppers-Totzek/Fischer-Tropsch process  	   116

D-13    Probabilities of chronic toxic effects on
        fish populations due to RAC 31 at annual
        median ambient concentrations for the
        Koppers-Totzek/Fischer-Tropsch process  	   117

D-14    Probabilities of chronic toxic effects on
        fish populations due to RAC 33 at annual
        median ambient concentrations for the
        Koppers-Totzek/Fischer-Tropsch process  	   118
D-15    Probabilities of chronic toxic effects on
        fish populations due to RAC 34 at annual
        median ambient concentrations for the
        Koppers-Totzek/Fischer-Tropsch process  	   119
                                   IX

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                                SUMMARY

     The Environmental Sciences Division, Oak Ridge National
Laboratory, is analyzing the potential environmental risks associated
with commercial-scale synthetic liquid fuels (synfuels) technologies.
The overall objective of this environmental risk analysis project,
which is funded by the Office of Research and Development, U.S.
Environmental Protection Agency, is to guide research on environmental
aspects of synfuel technologies by identifying the most hazardous
synfuel-derived contaminants and the most important sources of
scientific uncertainty concerning the fate and effects of these
contaminants.
     The general strategy adopted for the project involves (1) grouping
the contaminants present in effluents and products of commercial-scale
processes  into 38 categories termed Risk Analysis Categories (RACs),
(2) defining generalized reference environments with characteristics
representative of regions in which synfuels plants may be sited, and
(3) assessing risks of five distinct, adverse ecological effects:
reductions in fish populations, development of algal blooms that
detract from water use, reductions in timber yield or undesirable
changes in forest composition, reductions in agricultural production,
and reductions in wildlife populations.
     This  report analyzes the risks associated with two indirect coal
liquefaction technologies:  Lurgi gasification with Fischer-Tropsch
synthesis  and Koppers-Totzek gasification with Fischer-Tropsch
synthesis.  The plant configurations evaluated were adapted from design
information provided by the developers of the technologies.  Both
configurations reflect a feed coal capacity of 2.72 x 10  kg
(30,000 tons) per day.  Source terms for atmospheric and aqueous waste
streams were based on published process conceptual designs and test
data obtained from bench-scale, pilot, or demonstration units.  Control
technology efficiencies were extrapolated from similar applications in
other industries.

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     A reference environment resembling eastern  Kentucky or West
Virginia was employed in the risk analyses.   Estimates of
concentrations of released contaminants in the air,  soil, and surface
water of the reference environment, were obtained, using a simple
Gaussian-plume atmospheric dispersion and deposition model and a
steady-state surface water fate model.
     Risk to the five ecological endpoints were estimated using one or
more of three techniques:  the quotient method,  analysis of
extrapolation error, and ecosystem uncertainty analysiSi  in the
quotient method, estimated environmental concentrations were simply
                                                   *
compared to toxicological benchmarks such as LC  's  available for
standard test organisms.  In analysis of extrapolation error,
statistical relationships between the sensitivities to contaminants of
the various taxa of fish and between acute- and chronic-effects
concentrations were used to estimate, with appropriate error bounds,
chronic-effects thresholds for reference fish species characteristic of
the reference environment.  Taxonomic extrapolations were used to
express the acute effects of all RACs in terms of a common unit, the
96-h LCg0 for largemouth bass.  The extrapolated LCr  's and the
source term estimates were then combined and used to assess the acute
toxicities of the whole effluents from the two technologies.  In
ecosystem uncertainty analysis, an aquatic ecosystem model was used to
compute risk estimates that explicitly incorporate biological phenomena
such as competition and predation, which can magnify or offset the
direct effects of contaminants of organisms.
     With respect to fish, nine RACs were determined to be significant
for one or both technologies.  RAC 5 (ammonia) and RAC 34 (cadmium)
were the only RACs found to be significant for both technologies and
all risk analysis methods.  RAC 4  (acid gases) was significant for both
technologies, according to the quotient method and analysis of
extrapolation error; however, this RAC could not be addressed using
ecosystem uncertainty analysis.  The whole effluent from  the
       =  lethal does to 50% of population exposed.
                                  XII

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Lurgi-based technology appeared to be somewhat more acutely toxic than
the corresponding effluent from the Koppers-Totzek technology.  For
both technologies, conventional pollutants such as ammonia, cadmium,
and hydrogen sulfide appear to be substantially more hazardous to fish
than the complex organic contaminants usually associated with synfuels.
     Algal toxicity data were available for only ten RACs.  Because of
the diversity of experimental designs and test endpoints used in algal
bioassays, it was not possible to rank the RAC using the quotient
method.  However, most of the toxicity quotients calculated for algae
were lower than the corresponding quotients for fish.  Only RACs 33
(nickel) and 34 (cadmium) would be judged significant for any
technology using the quotient method.  Ecosystem uncertainty analysis
suggested greater risks of effects on algae than did the quotient
                          <
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                               ABSTRACT
     BARNTHOUSE,  L.  W.,  6.  U.  SUTER II,  C.  F.  BAES III,
          S. M.  BARTELL, M. G. CAVENDISH,  R.  H.  GARDNER,
          R. V.  O'NEILL, and A.  E.  ROSEN.   1984.   Environmental
          risk analysis  for indirect coal  liquefaction.
          ORNL/TM-9120.   Oak Ridge  National Laboratory,  Oak Ridge,
          Tennessee.  142 pp.

     This report presents an analysis of the risks to fish, water
quality (due to noxious  algal  blooms), crops,  forests, and wildlife of
two technologies for the indirect liquefaction of coal:   Lurgi  and
Koppers-Totzek gasification of coal for Fischer-Tropsch  synthesis.
A variety of analytical  techniques were used to make maximum use of
the available data to consider effects of effluents on different levels
of ecological organization.  The most significant toxicants to fish
were found to be ammonia, cadmium,  and acid gases.  An analysis  of
whole-effluent toxicity indicated that the Lurgi effluent is more
acutely toxic than the Koppers-Totzek effluent.   Six effluent
components  appear to pose a potential threat of blue-green algal
blooms, primarily because of their effects on higher trophic levels.
The most important atmospheric emissions with respect to crops,
forests, and wildlife were found to be the conventional  combustion
products S02 and NO^.  Of the materials deposited on the soil,
arsenic, cadmium, and nickel appear of greatest concern for
phytotoxicity.
                                   xv

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                            1.   INTRODUCTION

     Environmental risk analysis is the process of identifying and
quantifying the probabilities of adverse changes in the environment
resulting from human activities.  This includes explicit incorporation
and, to the extent possible, quantification of scientific uncertainties
relating to the adverse effects being considered.  The Environmental
Sciences Division, Oak Ridge National Laboratory, has been developing
and demonstrating methods for environmental risk analysis for the
Office of Research and Development, U.S. Environmental Protection
Agency (USEPA).  The methods being used in this project were described
by Barnthouse et al. (1982).  Although the concept of risk is
applicable to many types of environmental problems, this project
focuses on risks associated with toxic environmental  contaminants
derived from synthetic liquid fuels (synfuels) technologies.  The
overall objective of the project is to guide research on environmental
aspects of synfuel technologies by identifying the most hazardous
contaminants (or classes of contaminants) and the most important
sources of scientific uncertainty concerning the fate and effects of
contaminants.  The analyses, results, and conclusions of this research
are intended to be generic and are not estimates of actual impacts of
specific plants at specific sites.
     For purposes of risk analysis, the thousands of potentially
significant contaminants in waste streams and products of synthetic
liquid fuels technologies have been grouped into the 38 categories,
termed Risk Analysis Categories (RACs), listed in Table 1-1.  Five
ecological endpoints are used:  (1) reductions in fish populations,
(2) development of algal populations that detract from water use,
(3) reductions in timber yield or undesirable changes in forest
composition, (4) reductions in agricultural production, and
(5) reductions in wildlife populations.  Rather than descriptions of
specific sites, the risk analyses employ generalized reference
environments, with characteristics representative of regions in which
synfuels plants may be sited.  Two reference environments are being
used in the research for USEPA:  an eastern environment resembling

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ORNL/TM-9120
Table 1-1.  Risk Analysis Categories (RACs)
RAC Number
Name
                 Description
1
2
3
4
5
6
Carbon monoxide
Sulfur oxides
Nitrogen oxides
Acid gases
Alkaline gases
Hydrocarbon gases
CO
SOX
NOX
H2S, HCN
NH3
Methane through butanes,





acetylene, ethene
                                             through butenes;  C-|-C4 alkanes,  alkynes
     7       Formaldehyde
     8       Volatile organochlorines
     9       Volatile carboxylic acids
    10       Volatile 0 & S heterocyclics
    11       Volatile Nheterocyclics

    12       Benzene
    13       Aliphatic/alicyclic
               hydrocarbons

    14       Mono- or diaromatic hydro-
               carbons (excluding
               benzene)
    15       Polycyclic aromatic
               hydrocarbons
    16       Aliphatic amines (excluding
               Nheterocyclics)
    17       Aromatic amines (excluding
            •   Nheterocyclics)
    18       Alkaline N hetero-
               cyclics ("azaarenes")
               (excluding "volatiles")
    19       Neutral N, 0, S hetero-
               cyclics (excluding
               "volatiles")
    20       Carboxylic acids
               (excluding "volatiles")
    21       Phenols
    22       Aldehydes and ketones
               ("carbonyls")  (excluding
               formaldehyde)
    23       Nonheterocyclic organo-
               sulfur
    24       Alcohols
    25       Nitroaromatics
    26       Esters
    27       Amides
    28       Nitriles
    29       Tars
    30       Respirable particles
    31       Arsenic
    32       Mercury
    33       Nickel
    34       Cadmium
    35       Lead
    36       Other trace  elements
    37       Radioactive  materials
    38       Other remaining  materials
                           and cyclocompounds;  bp
                         HCHO
                         To bp -vl20°C;  CH2C1?,  CHC13
                         To bp -\.120°C  "   -
                         To bp %120°C
                             CC14
              formic and acetic acids only
              furan, THF, thiophene
To bp ^120°C; pyridine, piperidine,
  pyrrolidine, alkyl pyridines
Benzene
C$ (bp 'v40°C) and greater; paraffins,
  olefins, cyclocompounds, terpenoids, waxes,
  hydroaromatics
Toluene, xylenes, naphthalenes, biphenyls,
  alkyl derivatives

Three rings and greater; anthracene, BaA,
  BaP, alkyl derivatives
Primary, secondary, and tertiary nonhetero-
  cyclic nitrogen, MeNH2, diMeNH, triMeN
Anilines, napthylamines, amino pyrenes;
  nonheterocyclic nitrogen
Quinolines, acridines, benzacridines
  (excluding pyridines)

Indoles, carbazoles, benzofurans, dibenzo-
  thiophenes

Butyric, benzoic, phthalic, stearic

Phenol, cresols, catechol, resorcinol
Acetaldehyde, acrolein, acetone,
  benzaldehyde

Mercaptans, sulfides, disulfides,
  thiophenols, CS2
Methanol, ethanol
Nitrobenzenes, nitropyrenes
Acetates, phthalates, formates
Acetamide,  formamide, benzamides
Acrylonitrile, acetonitrile
                         As, all forms
                         Hg, all forms
                         Ni, all forms
                         Cd, all forms
                         Pb, all forms

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                                   3                      ORNL/TM-9120

eastern Kentucky or West Virginia, and a western environment resembling
the western slope of the Rocky Mountains in northern Colorado or
southern Wyoming.  Descriptions of the meteorology, hydrology,
demography, land-use patterns, and biota of these two reference
environments have been developed by Travis et al. (1983).  The indirect
coal liquefaction plants are assumed to be located in the east.
     This report analyzes risks associated with two indirect coal
liquefaction technologies:  Lurgi gasification with Fischer-Tropsch
synthesis and Koppers-Totzek gasification with Fischer-Tropsch
synthesis.  The  analyses assumed commercial-scale facilities, with
identical feed coal capacities and similar environmental control
technologies, sited in the eastern reference environment.  The
objectives of the risk analyses were (1) to identify the RACs of
greatest concern for each technology; (2) to compare, as far as
possible, the risk associated with different technologies;(3) to
compare the risks of the indirect coal liquefaction technology to the
five ecological  endpoints described above; and (4) to compare the
magnitudes of uncertainty concerning risks of different RACs and
different components of risk for each RAC.

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ORNL/TM-9120                       4

                     2.   SOURCE TERMS  AND  EXPOSURE

     This section presents (1) estimates of aqueous and atmospheric
source terms for four commercial-scale indirect  coal  liquefaction
plants, and (2) estimates of exposure  concentrations for aquatic and
terrestrial biota hear a hypothetical  plant site with environmental
characteristics that roughly correspond to those of proposed sites for
coal liquefaction factilities in eastern Kentucky and West Virginia.

2.1  SOURCE TERMS
     Under a subcontract with Oak Ridge National Laboratory, TRW Energy
Technology Division (TRW 1983) described commerical-scale plant
configurations for two indirect coal liquefaction processes:  Lurgi
gasification with Fischer-Tropsch synthesis and  Koppers-Totzek
gasification with Fischer-Tropsch synthesis.  The plant configurations
evaluated by TRW were adapted from design information provided by the
developers of the two technologies.  The source term estimates
developed by TRW were based largely on published process conceptual
designs and test data obtained from bench-scale, pilot, or
demonstration units.  Control technology efficiencies were extrapolated
from similar applications  in  other  industries.
     Both plant configurations  reflect  a feed coal capacity of
2.72 x  10  kg  (30,000 tons)  per day.   TRW  estimated  quantities  and
compositions of all  uncontrolled and  controlled waste  streams, expressed
in Risk Analysis Categories  (RACs),  (Sect.  1).   For  aqueous waste
streams, two alternative control  options  were considered:

     1.  Phenol extraction,  ammonia recovery, biological
         oxidation,  chemical  precipitation, and carbon
         adsorption.
     2.  Option 1, followed by forced evaporation and
         surface impoundment.  This implies zero discharge
         to surface water.

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                                   5                      ORNL/TM-9120

Because of the large number of atmospheric effluent sources associated
with each technology, the atmopheric source terms are not presented in
this report.  They are given in Tables 2-8 and 3-8 of the report by
TRW (1983).  The aqueous source terms for option 1 are summarized in
Table 2.1-1.  They include process-generated wastewaters, coal  pile
runoff, and cooling tower blowdown.  Control option 2 is a
zero-discharge control strategy; consequently, no source terms  are
presented.

2.2  AQUATIC EXPOSURE ASSESSMENT
     Estimates of contaminant concentrations in the surface waters of
the eastern reference environment were computed based on the source
terms described in the preceding section.  The model used for this
purpose was described by Travis et al. (1983).  The model used  for
the synfuels risk analyses is similar in concept to the EXAMS model
(Baughman and Lassiter 1978), but is simpler in process chemistry
and environmental detail.  A river is represented as a series of
completely mixed reaches.  Within each reach, steady-state contaminant
concentrations are computed, based on dilution and on physical/chemical
removal of contaminants from the water column.  Ranges and variances
can be placed on all of the environmental and chemical parameters in
the model to compute the frequency distribution of environmental
concentrations.  For this analysis, frequency distributions were
computed for all RACs, based on observed variability in environmental
parameters affecting contaminant transport and transformation.

2.2.1  Stream Characteristics
     The environmental parameters used in the surface water exposure
                            o
analysis were stream flow (m/s), stream width (m), reach length (m),
                                           o
sediment load (mg/L), sediment density (g/m ), the depth of the
biologically active sediment (cm), the fraction of organic carbon in
the sediment (unitless), stream temperature (K), current velocity
(m/s), wind velocity (m/s), and the radius of sediment particles (cm).
Estimates of stream flow, temperature, and suspended solids for the

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ORNL/TM-9120                       6


   Table 2.1-1.   Aqueous source terms (kg/h)  for two indirect coal
                  liquefaction technologies, control  option 1
RAC Lurgi/Fischer-Tropsch Koppers-Totzek/Fischer-Tropsch
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
31
32
33
34
35
36
4.3
59
0
0
0
35
4.4 E-05
0
4.2 E-03
2.8 E-04
2.3 E-02
3.4 E-02
0
0
0
8.9 E-03
3.5
0.19
6.7 E-05 -
0
1.7 E-02
0
7.6 E-06
0
0
3.8
4.0 E-02
0.40-0.46
4.2 E-02
0.48
8.4
1.8-3.8
18
0
0
0
320
0
0
1.7 E-04
5.9 E-03
3.4 E-04
1.4 E-04
0
0
0
0
0
6.9 E-04
6.3 E-04
0
0.23
0
7.0 E-05
0
0
1.2-1.3
3.6 E-03
0.08-0.22
2.4 E-02
0.10-0.11
200

-------
                                   7                      ORNL/TM-9120

eastern site were set within ranges observed by the U.S. Geological
Survey (US6S) for the Big Sandy River at Louisa, Kentucky, and the
Monongahela River at Braddock, Pennsylvania (USGS 1977, 1979).  Values
for the other stream parameters were taken from Southworth (1979).
                              o
Irradiance values [photons/(cm «s)] for estimating photolysis rates
were obtained from Zepp and Cline (1977).
     Probability distributions for flow, temperature, and suspended
solids were generated, based on the means, minima, and maxima of these
parameters observed at the USGS stations.  Normal distributions for
particle radius, organic carbon fraction, current velocity, and wind
velocity were derived from ranges used by Southworth (1979).   Because
current velocity and sediment load are influenced by stream flow, a
correlation coefficient of 0.7 was specified between flow and velocity
and between flow and suspended solids.  All environmental parameters
used in the exposure analysis are presented in Table 2.2-1.

2.2.2  Contaminant Characteristics
     For determining the characteristics of organic contaminants
(Table 2.2-2), the chemical properties used were molecular weight
(g/mol), aqueous solubility (g/L), octanol-water partition coefficient
(unitless), quantum yield of direct photolysis (unitless), molar
extinction coefficient [(cm«L)/mol], and vapor pressure (mmHg).
Although microbial degradation rates can be accommodated in the model,
none were used for this assessment.  Molecular weights of organic
compounds were obtained from Weast (1980); aqueous solubility data were
obtained from Verschueren (1977); octanol-water partition coefficients
were obtained from Leo et al. (1971) and Briggs (1981).  Equations
relating vapor pressure to ambient temperature were generated from data
points reported in Verschueren (1977).  These equations are linear
approximations that should provide adequate accuracy over the small
temperature range (280-310 K) involved.
     Derived characteristics of organic contaminants were calculated
using functional relationships obtained from the literature.  Henry's
Law coefficients were approximated using the method of Dilling (1977).

-------
ORNL/TM-9120
Table 2.2-1.  Stream characteristics for the eastern reference site
Environmental
parameter
Stream flow
Reach length
Stream width
Suspended solids
Sediment depth
Solids density
Fraction of organic
carbon
Particle radius
Temperature
Current velocity
Wind velocity
Units
m3/s
m
m
mg/L
cm
g/cm3

cm
K
m/s
m/s
Mean
value
120
1000
40
25
1
1.02
0.1
0.005
298
0.25
1.5
Standard
deviation
75
0
0
20
0
0
0.1
0.0025
3
0.1
0.1
Minimum
value
50
1000
40
1
1
1.02
0.05
0.001
283
0.1
0.25
Maximum
value
600
1000
40
250
1
1.02
0.25
0.01
310
1.0
4.0

-------
                                                              ORNL/TM-9120
Table 2.2-2.  Contaminant  characteristics
RAC
4
5
6
7
8
9
10
11
12
13
14
15
17
19
20
21
22
23
24
25
26
28
31
32
33
34
35
36
Molecular
or atomic
Representative weight3
contaminant (g/mol)
Hydrogen sulfide
Ammonia
Butane
Formaldehyde
Methylene chloride
Acetic acid
Thiophene
Pyridine
Benzene
Cyclohexane
Toluene
Anthracene
Anil ine
Dibenzofuran
Butanoic acid
Phenol
Acrolein
Methanethiol
Methanol
Nitrobenzene
Methyl phthalate
Acrylonitrile
Arsenic
Mercury
Nickel
Cadmium
Lead
Fluorine
34.06
17.03
58.12
30.03
84.93
60.05
84.14
79.10
78.12
84.16
92.15
178.24
93.13
168.21
88.1
94.11
56.07
48.11
32.04
123.11
194.19
53.06
74.92
200.59
58.71
112.40
207.19
19.00
Octanol -water Quantum
Aqueous partition yield of
solubility*3 coefficient photolysis
(g/L) (log P) (unitless)


6.1 E-02

1.67 E+01
3.80 E-02
4.43 E-01
3.00 E-02
1.78 E+00
5.5 E-02
5.15 E-01
7.50 E-05
3.40 E+01
3.00 E-03
5.62 E+01
8.20 E+01
9.74 E-01
4.00 E-05
2.7 E-01
1.9 E+00
5.0 E+00
3.83 E-01










-0.1 7C
1.81C
0.650C
2.13C
4.0°
2.69C
4.45C 0.003d
0.90C
4.12C
0.79C
1.46C
0.906
-0.660C
-0.74°
2.31e
-0.92C






3Weast (1980).
bVerschueren (1977).
cLeo et al. (1971).
 Zepp and Schlotzhauer  (1979).
eBriggs (1981).

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ORNL/TM-9120                       10

Mass transfer rates and dissolved fractions were calculated using the
method of Southworth (1979).  Particulate-settling velocities were
calculated from Stoke's Law (Weast 1980).  Direct photolysis rate
constants for anthracene were calculated using the method of Zepp and
Cline (1977).  Adsorption and desorption coefficients were approximated
using the method of Karickhoff et al. (1979).
     Because of their complex environmental chemistry, removal processes
for trace elements were not directly modeled.  Rates of removal by
sedimentation were estimated using an adsorption-desorption coefficient
of 200.  Schell and Sibley's (1982) study of distribution coefficients
for radionuclides suggests that this is probably a conservative
estimate for most trace elements under most environmental conditions.

2.2.3  Results
     Model runs were conducted for the reference stream, using the
source terms presented in Table 2.1-1.  The means, medians and upper
95% concentrations (i.e., the concentrations equaled or exceeded in 5%
of the Monte Carlo simulations) in 1-km stream reaches immediately
adjacent to the release sites are presented in Tables 2.2-3 and 2.2-4.
For all practical purposes, the concentrations computed using
contaminant-specific removal rates are identical to concentrations
computed from dilution alone.  Thus, at least in the immediate vicinity
of contaminant sources located on rivers such as the eastern reference
stream, the environmental removal processes modeled have very little
influence on steady-state contaminant concentrations.  It is possible,
however, that some of the processes not modeled  (e.g., hydrolysis,
complexation, or microbial degradation) may occur more rapidly than do
photolysis, sedimentation, and volatilization.

2.3  ATMOSPHERIC DISPERSION AND DEPOSITION
     The short-range atmospheric dispersion code AIRDOS-EPA (Moore
et al. 1979) was used in the environmental risk  analysis to calculate
ground-level atmospheric concentrations and deposition.  This code was
summarized by Travis et al.  (1983), who also described the method for

-------
                               11
ORNL/TM-9120
Table 2.2-3.  Estimated  ambient  contaminant concentrations,
              eastern  reference  stream, Lurgi/Fischer-Tropsch
              process
RAC
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
31
32
33
34
35
36
Reference compound
Hydrogen sulfide
Ammon i a
Butane
Formaldehyde
Methylene chloride
Acetic acid
Thiophene
Pyridine
Benzene
Cyclohexane
Toluene
Anthracene
Methyl amine
Aniline
Quinoline
Dibenzofuran
Butanoic acid
Phenol
Acrolein
Methanethiol
Methanol
Nitrobenzene
Methyl phthalate
Acetamide
Aery Ion itr ile
Arsenic
Mercury
Nickel
Cadmium
Lead
Fluorine
Mean
(g/L)
9.99 E-06
1.36 E-04
0
0
0
8.10 E-05
1.02 E-10
0
9.72 E-09
6.47 E-10
5.32 E-08
6.94 E-08
0
0
0
2.06 E-08
8.10 E-06
4.40 E-07
1.55 E-10
0
3.93 E-08
0
1.76 E-ll
0
1.2 E-05
8.85 E-06
9.52 E-08
1.06 E-06
9.69 E-08
1.12 E-06
1.96 E-05
Median
(9/L)
8.77 E-06
1.20 E-04
0
0
0
7.11 E-05
8.94 E-ll
0
8.54 E-09
5.68 E-10
4.67 E-08
6.45 E-08
0
0
0
1.81 E-08
7.11 E-06
3.86 E-07
1.36 E-10
0
3.45 E-08
0
1.54 E-ll
0
1.1 E-05
7.78 E-06
8.36 E-08
9.31 E-07
8.51 E-08
9.83 E-07
1.72 E-05
Upper 95%a
(9/L)
1.97 E-05
2.69 E-04
0
0
0
1.59 E-04
2.00 E-10
0
1.91 E-08
1.27 E-09
1.05 E-07
1.19 E-07
0
0
0
4.05 E-08
1.59 E-05
8.65 E-07
3.13 E-10
0
7.73 E-08
0
3.46 E-ll
0
2.5 E-05
1.74 E-05
1.88 E-07
2.09 E-06
1.91 E-07
2.20 E-06
3.85 E-05
 aConcentration expected to be equaled or exceeded  on  5% of  days.

-------
ORNL/TM-9120                          12
         Table  2.2-4.  Estimated ambient contaminant  concentrations, eastern
                      reference stream, Koppers-Totzek/Fischer-Tropsch
                      process
RAC
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
31
32
33
34
35
36
Reference compound
Hydrogen sulfide
Ammon i a
Butane
Formaldehyde
Methylene chloride
Acetic acid
Thiophene
Pyridine
Benzene
Cyclohexane
Toluene
Anthracene
Methyl amine
Aniline
Quinoline
Dibenzofuran
Butanoic acid
Phenol
Acrolein
Methanethiol
Methanol
Nitrobenzene
Methyl phthalate
Acetamide
Aery Ion itrile
Arsenic
Mercury
Nickel
Cadmium
Lead
Fluorine
Mean
(9/L)
8.9 E-06
4.2 E-05
0
0
0
7.4 E-04
0
0
3.9 E-100
1.4 E-08
7.9 E-10
2.9 E-10
0
0
0
0
0
1.6 E-09
1.5 E-09
0
5.3 E-07
0
1.6 E-10
0
0
3.1 E-06
9.1 E-09
5.2 E-07
6.0 E-08
2.4 E-07
4.7 E-04
Median
(g/L)
7.8 E-06
3.7'E-05
0
0
0
6.5 E-04
0
0
3.5 E-10
1.2 E-08
6.9 E-10
2.7 E-10
0
0
0
0
0
1.4 E-09
1.3 E-09
0
4.7 E-07
0
1.4 E-10
0
0
2.7 E-06
8.0 E-09
4.5 E-07
5.2 E-08
2.2 E-07
4.1 E-04
Upper 95%a
(9/L)
1.8 E-05
8.3 E-05
0
0
0
1.5 E-03
0
0
7.7 E-10
2.7 E-08
1.5 E-09
4.9 E-10
0
0
0
0
0
3.1 E-09
2.9 E-09
0
1.0 E-07
0
3.2 E-TO
0
0
6.1 E-06
1.8 E-08
1.0 E-06
1.2 E-07
4.8 E-07
9.2 E-04
         Concentration  expected to be equaled or exceeded on 5% of days.

-------
                                   13                      ORNL/TM-9120

calculating accumulation in soil.  Soil concentrations were calculated
for a 35-year accumulation period, using site-specific values for soil
bulk density, precipitation, evapotranspiration, and irrigation, and
taking into account removal by leaching, biological degradation, and
chemical degradation.  This calculation is performed using the food
chain model TERREX.
     Because most phytotoxicity  studies are done in solution culture,
we have added a calculated concentration in soil solution that is not
described  in previous documents.  For calculation of the soil solution
concentration, the total accumulation in the soil compartment is first
calculated by summing the material deposited over the lifetime of the
facility and correcting for leaching, degradation, and other removal
processes.  The retained material is then partitioned between the solid
and solution phases of the soil  compartment, assuming the relationship
                                    C.
                             r    =  1S
                             Liss   K
      C.   = the concentration of compound i in root zone soil
             solution  (yg/L),
        C.  = the concentration of compound i in root zone soil
             (vig/kg),  and
        K. = the distribution coefficient  (I/kg).

      Because Kd is  in  the  denominator  of Eq. (1), the soil solution
concentration  C.    could take on extremely high values with small values
of  K,.  To bound the maximum value  of  C.   ,  it is assumed that the
    d                                   iss
upper-bound concentration  is represented by  the total deposited  and
retained material divided  by the quantity of water  in the root zone
defined by d or
                      rmax    V1  -  exp(-Xs1  tfa)]
                      Liss  "      10  p  6  d\                             {  '

-------
ORNL/TM-9120                       14

where
      D. = the ground-level deposition rate of
       i                      2
             compound i [ug/(m *s)],
     X$i = the sum of all soil removal rate constants (L/s),
      tb = the period of long-term buildup in soil, equal to the length
           of time that the source term is in operation (s),
                                                2        2
      10 = conversion factor for converting g/cm  to kg/m
           [(10,000 cm2/! m2)
            (1 kg/1000  g)],
        p = soil  bulk density  (g/cm  ),
        6 = volumetric  water content (cm3/cm3),
        d =  the  depth of the root  zone (cm),
        r =  soil  volumetric water  content  (mL/cm  ).

 If Ciss calculated via Eq. (1) exceeds Cmax calculated  via Eq.  (2),
 then Ciss  is set equal to Cmax.  The value of 6 used in Eq. (2) is
 very important in providing a reasonable estimate of Cmax.  Since
 measured values of K. are usually under saturated conditions, 0 in
 Eq. (2) represents total soil porosity.
      These calculations generate sector-average ground-level
 concentrations in air, soil,  and soil solution in 16 directions at
 500 m intervals from  1,500 to 50,000 m from the source.  The highest
 annual  average concentrations in air and the highest soil and soil
 solution concentrations after 35 years of deposition are presented in
 Tables  2.3-1 and 2.3-2.

-------
                                                15
ORNL/TM-9120
Table 2.3-1.
             Maximum  ambient atmospheric and soil concentrations of RACs for the Lurgi/Fischer-Tropsch
             process
RAC
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
Name
Carbon monoxide
Sulfur oxides
Nitrogen oxides
Acid gases
Alkaline gases
Hydrocarbon gases
Formaldehyde
Volatile organochlorines
Volatile carboxylic acids
Volatile 0 & S heterocycl ics
Volatile Nheterocyclics
Benzene
Aliphatic/alicyclic hydrocarbons
Mono- or diaromatic hydrocarbons
Polycyclic aromatic hydrocarbons
Aliphatic amines
Aromatic amines
Alkaline N heterocyclics
Neutral N, 0, S heterocyclics
Carboxylic acids
Phenols
Aldehydes and ketones
Nonheterocycl ic organosulfur
Alcohols
Nitroaromatics
Esters
Amides
Nitriles
Tars
Kespirable particles
Arsenic
Mercury
Nickel
Cadmium
Lead
Otner trace elements
Radioactive materials
Annual average
concentration in air
(ug/m3)
4.63 E-01
8.5 E-01
3.69
8.41 E-03
3.65 E-03
39.1
b
b
b
7.86 E-04
b
1.18 E-02
5.34
5.29
1.14 E-02
b
b
b
4.73 E-04
b
4.74 E-03
0.910
8.18 E-04
3.95
b
b
b
b
b
28.9
7.66 E-04
1.91 E-05
1.06 E-03
1.39 E-05
1.28 E-02
7.25 E-03
6.33 E-04
Concentration
in soil
(ng/kg)
a
a
a
a
a
15.7
b
b
b
3.22 E-05
b
4.90 E-03
1.38
3.07
1.02
b
b
b
1.79 E-05
b
1.21
1.51
9.79 E-04
43.7
b
b
b
b
b
a
3700
3.04 E-03
4920
9.90
1.29 E-04
a
a
Concentration in
soil solution
(pg/L)
a
a
a
a
a
16.3
b
b
b
2.69 E-05
b
3.77 E-03
9.86
6.14 E-01
1.58 E-02
b
b
b
4.72 E-06
b
1.79
3.11
4.45 E-04
90.1
b
b
b
b
b
a
18.5
3.04 E-04
32.8
1.52
14.3
a
a
aNo accumulation in soil.

bNo emissions.

-------
ORNL/TM-9120
                                    16
 Table  2.3-2.
Maximum  ambient atmospheric and soil concentrations of RAUs  for the Koppers-Totzek/
Fischer-Tropsch process
RAC
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
Name
Carbon monoxide
Sulfur oxiaes
Nitrogen oxides
Acid gases
Alkaline gases
Hydrocarbon gases
Formaldehyde
Volatile organochlorines
Volatile carboxylic acids
Volatile 0 & S heterocyclics
Volatile Nheterocyclics
Benzene
Aliphatic/alicyclic hydrocarbons
Mono- or diaromatic hydrocarbons
Polycyclic aromatic hydrocarbons
Aliphatic amines
Aromatic amines
Alkaline N heterocyclics
Neutral N, 0, S heterocyclics
Carboxylic acids
Phenols
Aldehydes and ketones
Nonheterocycl ic organosulfur
Alcohols
Nitroaromatics
Esters
Amides
Nitriles
Tars
Respirable particles
Arsenic
Mercury
Nickel
Cadmium
Lead
Other trace elements
Radioactive materials
Annual average
concentration in air
(ug/m3)
22.4
6.87
5.92
0.135
3.70 E-05
50.0
b
b
b
b
b
5.71 E-05
6.55
6.52
0.0173
b
b
b
b
b
b
0.986
0.397
10.3
b
b
b
b
b
127
1.52 E-04
4.28 E-03
1.90 E-03
5.68 E-05
1.83 E-03
4.39 E-02
1.18 E-03
Concentration
in soil
(ug/kg)
a
a
a
a
a
20.1
b
b
b
b
b
2.38 E-05
169
3.78
1.55
b
b
b
b
b
b
2.13
0.475
1680
b
b
b
b
b
a
360
6.83 E-01
3000
17.6
976
a
a
Concentration in
soil solution
(ug/L)
a
a
a
a
a
20.8
b
b
b
b
b
1.83 E-05
12.1
0.757
0.0239
b
b
b
b
b
b
4.39
0.216
3450
D
b
b
b
b
a
1.80
6.83 E-02
20
2.71
1.08
a
a
 aNo accumulation in soil.

 bNo emissions.

-------
                                   17                      ORNL/TM-9120

                         3.  AQUATIC ENDPOINTS

3.1  QUOTIENT METHOD
     Also known as the "ratio method," this approach to assessing the
relative hazard of several constituents has been used in such fields as
environmental health and epidemiology.  The quotient is calculated from
the ratio of the known or estimated concentration of a chemical  in the
environment to a concentration of that chemical proven or calculated
(by extrapolation from experimental data) to be toxic to certain
organisms at a particular test endpoint.  The endpoint, known as a
toxicological benchmark, may be one of several, among them the USEPA
water quality criteria (USEPA 1980a-p), the effective concentration
causing a designated effect on 20% of the test organisms, (EC2Q),
mean toxic concentration, (MTC), lowest observed toxic concentration
(LOTC), median tolerance limit (TL ), and the concentration required
to kill 50% of the test organisms (IC™).
     Since this report compares potential toxic differences between
groups of chemicals (RACs), benchmarks common to as many of the RACs as
possible were preferred.  LC™ and TL , the two benchmarks most
                            \J\J       III
frequently found in aquatic toxicological literature, were selected to
represent acute toxicity (Table A-l).  Chronic effects are presented as
the geometric mean maximum allowable toxicant concentration (GMATC),
which is the geometric mean of the highest no-observed-effect
concentration and the lowest observed-effect concentration (Table A-2).
In contrast, benchmarks used in algal tests can vary between studies;
therefore, a variety of test endpoints were selected for this report
(Table A-3).
     Appendix A does not include all extant data on the responses of
freshwater organisms to the test chemicals.  For example, for the heavy
metals, data were excluded for the sake of brevity, but several
representative values are included.
     As in the selection of benchmarks, the test species chosen for
tabulation were those that appear most frequently in the literature.
Invertebrates were usually represented by cladocerans  (Daphnia species),
with insect data presented when available.  The fish species selected

-------
 ORNL/TM-9120                       18

 are  those usually used in toxicity testing, namely, fathead minnows
 (Pimephales promelas), bluegills (Lepomis macrochirus), and rainbow
 trout  (Salmo gairdneri).  Data for algal assays are sparse, so all
 species  appearing in the  literature, to our knowledge, were included
 in Table A-3.
      Tables 3.1-1 and 3.1-2 present the highest quotients for each RAC
 and  category of  effect for the two indirect liquefaction technologies.
 The  acute toxicity  quotients were calculated using the upper 95th
 percent!le concentration  (an estimate of the worst acute exposure,
 assuming stable  plant operation).  The chronic quotients were calculated
 using  the annual median concentration, and the algal quotients were
 calculated for both concentrations, since the distinction between acute
 and  chronic effects is not clear for algae.  The higher the value of
 these  quotients, the greater the risk of acute effects on organisms in
 the  reference stream.
      Quotients are  interpreted according to the best judgment of the
 analyst  (Barnthouse et al. 1982).  A value of 0.01 (1.0 E-02) or less
 indicates little apparent environmental significance, 0.01 to 10
 suggests possible or potential adverse effects, and greater than 10
 describes a chemical of probable environmental concern.  The utility of
 these  screening criteria for risk analysis must be confirmed by further
 experience in risk  analysis and by field studies.
     Ammonia (alkaline gases - RAC 5) and hydrogen sulfide
 (acid  gases - RAC 4) appear to be the most serious ichthyotoxin in the
effluents of both technologies, with quotients for fish acute toxicity
greater  than 1.0 for both.  Cadmium (RAC 34) also appears to be a
general  problem, with fish quotients greater than 0.1 for acute
toxicity in both technologies.  Quotients greater than 0.01 for acute
or chronic toxicity appeared in both technologies for mercury (RAC 32),
lead (RAC 35), and  other trace elements (RAC 36).  No organic RACs had
quotients greater than 0.01 for either technology.  Fewer RACs appear
to be  important for algal toxicity due to both the shortage of algal
toxicity data and the relative insensitivity of algae to several
tested RACs.   Only  nickel (RAC 33) and cadmium (RAC 34) had quotients
greater than  0.01 for either technology.

-------
                                                    19
ORNL/TM-9120
Table 3.1-1.   Toxicity  quotients for toxicity to fish  and  algae (ambient contaminant  concentration/toxic
              benchmark concentration) for Lurgi/Fischer-Tropsch process
Highest quotient3
RAC
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15

16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
Name
Carbon monoxide
Sulfur oxides
Nitrogen oxides
Acid gases
Alkaline gases
Hydrocarbon gases
Formaldehyde
Volatile organochlorines
Volatile carboxylic acids
Volatile 0 & S heterocyclics
Volatile Nheterocyclics
Benzene
Al iphatic/al icycl ic hydrocarbons
Mono- or diaromatic hydrocarbons
Polycyclic aromatic
hydrocarbons
Aliphatic amines
Aromatic amines
Alkaline N heterocyclics
Neutral N, 0, S heterocyclics
Carboxylic acids
Phenols
Aldehydes and ketones
Nonheterocyclic organosulfur
Alcohols
Nitroaromatics
Esters
Amides
Nitriles
Tars
Respirable particles
Arsenic
Mercury
Nickel
Cadmium
Lead
Other trace elements
Fish (acute)
95%
b
b
b
2.18 E+00
3.95 E+00
b
b
b
1.81 E-03
c
b
3.61 E-06
9.1 E-08
4.55 E-05
2.97 E-03

b
b
b
c
8.85 E-05
1.12 E-04
6.81 E-06
b
c
b
4.74 E-08
b
b
b
b
1.31 E-03
7.81 E-03
4.54 E-04
1.91 E-01
3.67 E-03
1.67 E-02
Fish (chronic)

b
b
b
c
c
b
b
b
c
c
b
c
c
7
c

b
b
b
c
c
1
6
b
c
b
1
b
b
b
b
1
3
8
5
5
1
Median













.54 E-05







.76 E-04
.47 E-06



.93 E-06




.56 E-03
.64 E-01
.54 E-03
.01 E-02
.18 E-02
.52 E-04
Algae
Median




c
b
b
b
c
c
b
1.63 E-08
c
1.42 E-06
1.14 E-06

b
b
b
c
c
1.93 E-05
c
b
c
b
1.40 E-07
b
b
b
b
3.35 E-03
1.05 E-03
9.31 E-03
1.70 E-02
1.97 E-03
c












3.64

3.17
2.18

b
b
b
c
c
4.33
c
b
c
b
3.15
b
b
b
b
7.51
2.34
2.09
3.81
4.41
c
9-5%











E-08

E-06
E-06






E-05




E-07




E-03
E-03
E-02
E-02
E-03

 aTne quotients are calculated using  the  lowest acute LC$Q or TLm for  fish  in each RAC (Table A-l),  the
  lowest chronic response by a fish  (Table A-2), and the lowest algal  response (Table A-3)  with  either the
  median or upper 95th percentile of  the  predicted ambient contaminant concentration (Table 2.2-3).

 DNo effluent.

 cNo toxicity data.

-------
 ORNL/TM-9120
20
  Table 3.1-2.  Toxicity  quotients for toxicity to fish and algae (ambient  contaminant concentration/toxic
               benchmark concentration)  for  Koppers-Totzek/Fischer-Tropsch process
Highest quotient*
RAC
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
Fish (acute)
Name 95%
Carbon monoxide b
Sulfur oxides b
Nitrogen oxides b
Acid gases 1.95 E+00
Alkaline gases 1.22 E+00
Hydrocarbon gases b
Formaldehyde b
Volatile organochlorines b
Volatile carboxylic acids 1.65 E-02
Volatile 0 & S heterocyclics b
Volatile Nheterocyclics b
Benzene 1 .46 E-07
Aliphatic/alicyclic hydrocarbons 1.92 E-06
Mono- or diaromatic hydrocarbons 6.73 E-07
Polycyclic aromatic hydrocarbons 1.22 E-05
Aliphatic amines b
Aromatic amines b
Alkaline N heterocyclics b
Neutral N, 0, S heterocyclics b
Carboxylic acids b
Phenols 4.05 E-07
Aldehydes and'ketones 6.23 E-05
Nonheterocycl ic organosulfur b
Alcohols c
Nitroaromatics b
Esters 4.37 E-07
Amides b
Nitriles b
Tars b
Respirable particles b
Arsenic 4.54 E-04
Mercury 7.43 E-04
Nickel 2.21 E-04
Cadmium 1 .17 £-01
Lead 8.04 E-04
Other trace elements 3.98 E-01
Fish (chronic)
Median
b
b
b
c
c
b
b
b
c
b
b
c
c
1.11 E-06
c
b
b
b
b
b
6.40 E-07
6.10 E-05
b
c
0
1.78 E-05
b
b
b
b
5.4 E-04
3.46 E-02
4.16 E-03
3.08 E-02
1.13 E-02
3.62 E-03

Algae
Median 95%
b
b
b
c
c
b
b
b
c
b
b
6.58
c
2.09
4.88
b
b
b
b
b
7.01
c
b
c
b
1.29
b
b
b
b
1.16
9.94
4.54
1.05
4.30
c
b
b
b
c
c
b
b
b
c
b
b
E-10 1.47 E-09
c
E-08 4.69 E-08
E-09 8.99 E-09
b
b
b
b
b
E-08 1.57 E-07
c
b
c
b
E-06 2.90 E-06
b
b
b
b
E-03 2.61 E-03
E-05 2.23 E-04
E-03 1.02 E-02
E-02 2.34 E-02
E-04 9.64 E-04
c
 The quotients are calculated  using the lowest acute LC5n or TLm  for fish  in each RAC (Table A-l),  the
 lowest chronic response  by  a  fish (Table A-2), and the lowest  algal response (Table A-3) with either the
 median or upper 95th  percentile of the predicted ambient contaminant concentration (Table 2.2-4).

DNo effluent.

cNo toxicity data.

-------
                                   21                      ORNL/TM-9120

     Barnthouse et al. (1982) discussed the uncertainties involved in
applying the quotient method to environmental data.  One of the major
inherent problems is that of comparing results from dissimilar tests.
Although an attempt was made in this analysis to avoid such pitfalls
by comparing, when possible, the same test species and benchmarks,
uncontrolled variables inevitably remain.  For example, in tests with
certain metals (RACs 33, 34, and 35), water hardness is important in
determining the concentrations of these metals that are required to
elicit a toxic response (Table 3.1-1), a fact reflected in the
USEPA criteria for each.  Usually, the data are insufficient to compare
quotients from tests using the same organisms in both soft and hard
waters.  Also, in some instances, the analyst must compare quotients
derived from tests using water of unspecified or inconsistent quality.
     This exercise with the quotient method, in addition to suggesting
which of the assigned RACs pose the greatest potential environmental
threat, emphasizes the lack of toxicological research on algae as
important components of the ecosystem and on synfuels-related organic
compounds in general.  Despite obvious weaknesses, the method does
provide a useful means of screening data from a variety of sources.

3.2  ANALYSIS OF EXTRAPOLATION ERROR
     This method of risk analysis is based on the fact that application
of the results of laboratory toxicity tests to field exposures requires
a series of extrapolations, each of which is made with some error
(Barnthouse et al. 1982).  The products of the extrapolation are
estimates of the centroid and distribution of the ambient concentration
of a chemical at which a particular response will occur.  The risk of
occurrence of the prescribed response is equal to the probability that
the response concentration is less than the ambient concentration,
given the probability distribution of each.  In this section, we
extrapolate from acute toxic concentrations for test species of fish to
chronic responses of the reference commercial and game species
characteristic of the eastern reference site (Travis et al.  1983).  The
acute toxicity criterion is the 96-h LCrn.  The chronic toxicity

-------
 ORNL/TM-9120                       22

 criterion  is  the  life-cycle maximum allowable toxicant concentration
 (MATC),  an  interval bounded by the highest no-observed-effects
 concentration and the  lowest concentration causing  a  statistically
 significant effect on  growth, survival, or reproduction  in a  life-cycle
 toxicity test (Mount and Stephan  1969).  The geometric mean of the
 bounds  (GMATC)  is used as a point estimate of the MATC,  as was done in
 calculating the national water quality criteria  (USEPA 1980a-p).

 3.2.1   Methods
      The computational methods used for the analysis  of  extrapolation
 error (AEE) were described by Suter et al. (1983).  Acute toxicity data
 from the Columbia National Fisheries Research Laboratory (Johnson and
 Finley 1980)  were used for the extrapolation between  species.
 Life-cycle toxicity data  (Suter et al.  1983) were  used  to develop a
 regression relationship between acute toxicity data and  chronic
 toxicity data.  Variances associated with extrapolating  acute toxicity
 between taxa  and acute to chronic toxicity were  accumulated to provide
 an estimate of the variability associated with the  estimate of chronic
 toxicity;  they were also used in  obtaining estimates  of  risk, given
 estimates  of  the distribution of  the ambient contaminant concentrations.
      All of the emitted RACs for  which 96-h LCcn's  could be found
                                              bU
 (Table  A-l) have been  analyzed by the extrapolation error method.
 The quotient  of the ratio of the  ambient concentration of a RAC  to its
 predicted  GMATC (PGMATC) is presented as an estimate  of  the hazard of
 chronic toxicity. Risk, which is defined as the probability  that the
 ambient  contaminant concentration exceeds the GMATC,  is  also  presented.
 Both the hazard and risk estimates are based on  the mean ambient
 concentrations  (Tables 2.2-3 and  2.2-4).
      In  general,  the extrapolation between species  was done using the
 regression  relationship between the tested and assessed  fish  at  the
 same taxonomic  level and having in common the next  higher level.  For
 example, if the fish are in the same family but  different genera, the
 extrapolation would be made between genera.  There  were  three instances
when our hierarchical   approach failed because of the  limitation  in the
 acute toxicity  data for the contaminant.  The only  acute toxicity data

-------
                                   23                      ORNL/TM-9120

available for hydrogen sulfide (RAC 4) and for fluoranthene (RAC 15)
were for bluegill sunfish  (Lepomis macrochirus), and the only acute
toxicity data available for indan (RAC 13) and for quinoline (RAC 18)
were for fathead minnows (Pimephales promelas).  Difficulties arose
with RAC 15 for estimating the acute toxicity of white bass (Morone
chrysops) and with RAC 13 for estimating the acute toxicity of bigmouth
and smallmouth buffalo (Ictiobus cyprinellus and I_. bulbalus).  The
problem arose because no fish in the family Percichthyidaea or in the
genus Ictiobus were tested at the Columbia National Fisheries Research
Laboratory.  The genus Ictiobus is in the family Catostomidae, which
was tested at the Columbia National Fisheries Research Laboratory,  but
the Cyprinidae-Catostomidae relationship had insufficient sample size
(n = 1).  Hence, further statistical relationships were developed
comparing bluegill sunfish with all Perciformes other than bluegills
  p
(R  = 0.91) and fathead minnow with all Cypriniformes other than
fathead minnow (R2 = 0.92).

3.2.2  Results
     The species-specific  values of the PGMATCs, quotients, and the
risks of exceeding the GMATC for the annual median ambient contaminant
concentrations are presented in Appendix D.  These species-specific
values are presented only for those RACs with a hazard greater than or
equal to 0.01.  They are summarized in Tables 3.2-1 and 3.2-2 for the
two technologies.  Hydrogen sulfide (RAC 4) and ammonia (RAC 5), with
quotients and risks greater than 0.1 for all species and technologies,
appear to present the most consistent threat of chronic toxicity to
fish.  For both technologies, the predicted risks  of ammonia and
hydrogen sulfide are greater than 0.5 for most or  all species.
Volatile carboxylic acids  (RAC 9) appear to be as  important as ammonia
and hydrogen sulfide for the Koppers-Totzek process.  For the Lurgi
process, the quotients and risks for RAC 9  are substantially  smaller
than those for RACs 4 and  5, but are still  high enough to cause
concern.  The only other RACs with hazard or risk  values  greater than
0.1 for any combination of species and technology  are carboxylic acids
(RAC 20), arsenic  (RAC 37), mercury  (RAC 32),  and  cadmium (RAC  34).

-------
 ORNL/TM-9120                           24
 Table 3.2-1.  Ranges of predicted geometric means of maximum allowable toxicant
              concentrations (PGMATC):  ratios of ambient concentrations to PGMATC,
              and probabilities of exceeding the PGMATC for the
              Lurgi/Fischer-Tropsch process


                                     Ratio of                   Probability of
 RAC                      ambient concentration to PGMATC     exceeding the PGMATCa
1
2
3
4b
5b
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
i-i
32b
32AD
33°
34b
35b
No effluent
No effluent
No effluent


No effluent
No effluent
No effluent

No fish toxicity data
No effluent




No effluent
No effluent
No effluent
No fish toxicity data



No effluent
No fish toxicity data
No effluent

No effluent
No effluent
No effluent
No effluent









0.7580-5.6337
2.7565-6.6493



0.0756-0.3336


0.0000-0.0001
0.0000-0.0000
0.0003-0.0007
0.0003-0.0029




0.0002-0.0050
0.0008-0.0075
0.0000-0.0001



0.0000-0.0000




0.0162-0.1161
0.0024-0.0060
0.0072-0.0187
0.0011-0.0325
0.0011-0.1617
0.0024-0.0183



0.4529-0.7859
0.6832-0.8330



0.0945-0.3098


0.0000-0.0000
0.0000-0.0000
0.0000-0.0005
0.0000-0.0040




0.0000-0.1130
0.0001-0.0152
0.0000-0.0000



0.0000-0.0000




0.0123-0.1721
0.0023-0.0056
0.0101-0.0216
0.0008-0.0670
0.0001-0.1816
0.0004-0.0329
aSpecies-specific values are provided in Appendix D.

bAmbient concentration includes demineralizer regeneration wastewater.

-------
                                         25                         ORNL/TM-9120
Table 3.2-2.   Ranges of predicted geometric  means of maximum allowable toxicant
              concentratons (PGMATC),  ratios of  ambient concentrations to PGMATC,
              and probabilities of exceeding the PGMATC3 for the
              Koppers-Totzek/Fischer-Tropsch process
RAC
1
2
3
4b
5b
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31b
32b
32Ab
33b
34b
35b

No effluent
No effluent
No effluent


No effluent
No effluent
No effluent

No effluent
No effluent




No effluent
No effluent
No effluent
No effluent
No effluent


No effluent
No fish toxicity
No effluent

No effluent
No effluent
No effluent
No effluent






Ratio of
ambient concentration to PGMATC



0.6753-5.0189
0.8527-2.0569



0.6911-3.0498


0.0000-0.0000
0.0001-0.0002
0.0000-0.0000
0.0000-0.0000





0.0000-0.0000
0.0001-0.0005

data

0.0000-0.0000




0.0056-0.0403
0.0002-0.0006
0.0007-0.0018
0.0005-0.0173
0.0007-0.0993
0.0005-0.0040
Probability of
exceeding the PGMATC3



0.4334-0.7701
0.4701-0.6435



0.4256-0.6930


0.0000-0.0000
0.0000-0.0000
0.0000-0.0000
0.0000-0.0000





0.0000-0.0000
0.0000-0.0003



0.0000-0.0000




0.0022-0.0792
0.0000-0.0002
0.0003-0.0008
0.0003-0.0343
0.0000-0.1246
0.0000-0.0034
aSpecies-specific values are provided in Appendix D.

bAmbient concentration includes demineralizer regeneration  wastewater.

-------
 ORNL/TM-9120                       26

      The  differences in the relative rankings between species  is
 attributable to variation in three factors:  (1) the magnitudes of
 the  LC   's  of different species that have been tested for a
      bO
 particular  chemical, (2) differences in sensitivity that are expressed
 as biases in the extrapolation between the test species and site
 species,  and  (3) the variance associated with the extrapolation.

 3.2.3  Toxicity of the whole Effluent
      Table  3.2-3 presents estimates of the acute toxicity of the whole
 effluent.   Only acute toxicity is considered because there is  no theory
 for  modeling  addition of effects expressed as toxic thresholds such  as
 GMATCs.   The  acute effects are expressed in a common unit, the 96-h
 LC5Q to largemouth bass, which is generated by taxonomic
 extrapolation from LC5Q data for a variety of species (Appendix A),
 using the method of Suter et al. (1983).
      The  possible modes of joint action of chemicals are synergism,
 concentration addition, independent action (response addition),
 and  antagonism  (Muska and Weber 1977).  Concentration addition is
 generally accepted to be the best general model for describing the
 combined  effects of mixed chemicals on fish (Alabaster and Lloyd 1982;
 EIFAC 1980; SGOMSEC, in press).  In a recent review, Lloyd (in press)
 stated:   "There is no evidence for synergism (i.e., more-than-additive
 action) between the common pollutants; at toxic concentrations the
 joint action  is additive and at concentrations below those considered
 'safe' there is circumstantial evidence for less-than-additive joint
 action."  Furthermore, Parkhurst et al. (1981) found that when ammonia
 speciation  is accounted for, the toxicity of the major components of
 two  synfuels effluents was concentration additive.  Therefore, we used
 the  concentration addition model to examine the potential toxicity of
 the  combined RACs.
     The analysis was performed by calculating the total toxic units
 (ITU) of the effluent, where a toxic unit is the concentration of a
 toxicant divided by the threshold LC™ (Sprague and Ramsay 1965).  We
used  the upper 95th percentile of the predicted concentration, since
the concern in this case is with acute lethality, and we used  the 96-h

-------
                                   27
                                             ORNL/TM-9120
Table 3.2-3.
Estimated acute LC^g for largemouth bass and ratio of
upper 95th percent!le of the ambient concentration to the
LCso for the Lurgi/Fischer-Tropsch and Koppers-Totzek/
Fischer-Tropsch processes
RAC
1
2
3
4a
5a
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31a
32a
32Aa
33a
34a
35a
Total
LC50
(mg/L)
No toxicity data
No toxicity data
No toxicity data
36.3
444
5,716,048
No toxicity data
52,048
10,511
No toxicity data
No toxicity data
4815
2324
2296
3310
No toxicity data
No toxicity data
6171
No toxicity data
184,876
14,282
160
No toxicity data
No toxicity data
No toxicity data
601
No toxicity data
9437
No toxicity data
No toxicity data
22,236
321
74.6
4496
1696
20,865

Concentration/LC
50
Lurgi Koppers-Totzek



5.42 E-01
6.05 E-01
No effluent

No effluent
1.52 E-02


3.97 E-06
5.48 E-07
4.56 E-05
3.59 E-05


No effluent

8.62 E-05
6.06 E-05
1.96 E-06



5.76 E-08

No effluent


7.84 E-04
5.84 E-04
2.51 E-03
4.64 E-04
1.12 E-04
1.06 E-04
1.17



4.82 E-01
1.87 E-01
No effluent

No effluent
1.39 E-01


1.61 E-07
1.15 E-05
6.74 E-07
1.48 E-07


No effluent

No effluent
2.20 E-07
1.79 E-05



5.30 E-07

No effluent


2.72 E-04
5.55 E-05
2.39 E-04
2.26 E-04
6.91 E-05
2.31 E-05
0.81
 aAmbient concentration  includes  demineralizer  regeneration wastewater.

-------
 ORNL/TM-9120                       28

 LC™  as  a  reasonable approximation of the threshold LC™  (Ruesink
   50                                                   DU
 and Smith  1975).  The ZTU of 1.17 for Lurgi gasification  suggests  a
 high  likelihood of  acute toxic effects from its effluent.   This  is
 almost entirely due to RAC 4 (acid gases - hydrogen sulfide) and RAC  5
 (alkaline  gases - ammonia).  The ZTU of 0.81 for Koppers-Totzek
 gasification  is less than unity, but Alabaster et al.  (1972) found that
 only  "coarse  fish"  were present when the ZTU based on  the upper  95th
 percentile concentration and on rainbow trout 48-h LC^'s was  above
 0.6.   Therefore, the total toxicity of this effluent,  which is
 primarily  due to RAC 4, RAC 5, and RAC 9 (volatile carboxylic  acids),
 also  seems worthy of concern.

 3.3   ECOSYSTEM UNCERTAINTY ANALYSIS
 3.3.1  Explanation  of Method
      Ecosystem uncertainty analysis (EUA) estimates the risk associated
 with  both  direct and indirect effects of toxicants.  It considers  data
 on a  variety  of test organisms rather than emphasizing a  single
 taxonomic  group.  By integrating effects across trophic levels,  EUA
 considers  components of environmental risk that are not included in
 other methods.
      The method uses the Standard Water Column Model (SWACOM)  (O'Neill
 and Giddings  1979;  O'Neill et al. 1982). SWACOM is an  adaptation of
 an earlier model, CLEAN (Park et al. 1974), and considers ten
 phytoplankton, five zooplankton, three forage fish, and a game fish
 population.   The model simulates the annual cycle of a lake and
 incorporates  temperature, light, and nutrient responses.  Changes  can
 be made  to tailor SWACOM for toxicological assessments in a variety of
 aquatic  ecosystems. The model is designed to simulate  a generalized
 water column  and sacrifices site specificity to emphasize complex
 interactions  and indirect effects.
     Available toxicity data are primarily in the form of mortalities.
Therefore,  assumptions about the mode of action of the toxicant  are
required to determine changes in model parameters.  We have assumed
that  organisms respond to all chemicals according to a general stress

-------
                                   29                      ORNL/TM-9120

syndrome; that is, they increase their respiration rates, decrease
their photosynthetic and feeding rates, and become more susceptible to
predation.  This assumption permits us to define percent changes in
model parameters that cause the same mortality as measured in the
laboratory.  This extrapolation of laboratory data involves considerable
uncertainty.  In our analysis, the uncertainties are preserved by
associating each parameter change with a probability distribution.   In
calculating risk, parameter values are selected from the distributions
and a simulation is performed with SWACOM.  The process is repeated
500 times. The risk associated with an undesirable effect, such as  a
significant reduction in game fish, is estimated by the frequency of
simulations that showed this effect.  Further details of the method
are given in Appendix E and by O'Neill et al. (1982).
     The data used for the EUA are shown in Table 3.3-1.  Estimates of
risk can be made for only ten RACs.  These RACs were the only chemical
groups for which adequate data exist.

3.3.2  Results of Ecosystem Uncertainty Analysis
     Results of the EUA for the direct liquefaction technologies are
shown in Figs. 3.3.1 to 3.3.3.  Deterministic results are shown on
Table 3.3-2.  None of the technologies produces measureable amounts of
quinoline (RAC 18), so this risk assessment unit was not considered in
the analysis.  Environmental concentrations of benzene (RAC 12),
naphthalene (RAC 14), and phenol (RAC 21) were very low and did not
result in significant risks; therefore, results for these three
chemicals are not shown on the graphs.
     Two endpoints were considered:  a quadrupling of the peak biomass
of noxious blue-green algae and a 25% decrease in game fish biomass.
These endpoints were chosen as indicative of minimal effects that could
be quantified in the field.  Risk estimates were calculated for these
endpoints across a range of environmental concentrations that
encompasses the 5th to 95th percentile exposures.  The range of
exposures for each technology is shown at the bottom of the figures.

-------

Table 3.3-1.
Trophic
level
Algae


Zooplankton




Forage fish


Game fish




Values3 of LC50/EC5o (mg/L) used to calculate
Model
species
1-3
4-7
8-10
11
12
13
14
15
16
17
18
19
Ammon i a
420.0
420.0
420.0
8.0
8.0
8.0
8.0
8.0
1.1
8.2
23.7
0.41
Benzene
525.0
525.0
525.0
450.0
380.0
300.0
233.8
17.6
33.0
22.0
34.0
5.3
Naphthalene
33.0
33.0
33.0
8.6
8.6
6.5
4.5
2.5
6.6
78.3
150.0
2.3






ro
O
effects matrix for SWACOM
Quinoline
25.0
25.0
117.0
57.2
28.5
48.2
39.3
30.3
1.5
1.5
1.5
11.0
Phenol
258.0
20.0
95.0
300.0
36.4
58.1
157.0
14.0
36.0
16.4
34.9
9.0
Arsenic
2.32
2.32
2.32
4.47
5.28
1.35
2.49
0.51
15.6
41.8
26.0
13.3
Nickel
0.50
0.50
0.50
9.67
0.85
1.93
4.91
0.15
4.87
5.27
4.45
0.05
Cadmium
0.16
0.06
0.06
0.5
0.0099
0;14
0.25
0.0035
0.63
1.94
1.63
0.002
Lead
0.50
0.50
0.50
40.8
0.45
27.4
14.0
0.67
4.61
23.8
31.5
1.17
Mercury
0.01
0.01
0.01
0.78
0.005
0.53 c
0.27
0.01
0.15
0.24
0.50
0.25
aValues taken  from following  Water  Quality Criteria  documents:   ammonia  - Hohreiter  (1980); benzene - USEPA (1980c);
 naphthalene - USEPA  (1980e); quinoline  -  O'Neill et al.  (1982); phenol  - USEPA  (1980g); arsenic - USEPA (19801);
 nickel -  USEPA (1980n);  cadmium  -  USEPA (1980o); lead  -  USEPA  (1980p);  and mercury  - USEPA (1980m).

-------
                                   31
                               ORNL/TM-9120
10
  ,-1
10'
        I  I I I  I M |     I  I

        NICKEL
             ALGAE.
           ,K
                     H  _
        l  i i i i i i I
    i   l  l  l l i ll
: ARSENIC
                                                    ORNL-DWG 83-16213
        K
                                    H
    l   i  i  i l i l i I
  i   i  i i  i i ii T     i

LEAD
   ,K
                                                                   -\ -
              icr3     icr3            io~2  io~4
                       CONCENTRATION (mg L'1)
                                    10
                                      -3
Fig. 3.3.1.   Risk estimates for three heavy metals over a range of
             environmental concentrations.  The  5th percentile, mean,
             and 95th percentile concentrations  associated with the
             Lurgi/Fischer-Tropsch  (L) and Koppers-Totzek/Fischer-Tropsch
             (K) processes are shown at the bottom of each graph.  The
             plotted values are the probability  of a quadrupling of the
             blue-green algal bloom and a 25% reduction in game fish
             biomass.

-------
ORNL/TM-9120
                                  32
                                                 ORNL-DWG 83-16212
   10"
                MERCURY
                                                    ALGAE
                       K
 L
                       10'
                         ,-5
10"
  r4
                        CONCENTRATION  (mg  L"1)
 Fig. 3.3.2.  Risk estimates for mercury over a range of environmental
             concentrations.  The 5th, mean, and 95th percentile
             concentrations associated with the Lurgi/Fischer-Tropsch
             (L)  and Koppers-Totzek/Fischer-Tropsch (K) processes are
             shown at the bottom of  the graph.  The plotted  values are
             the  probability of a quadrupling of the blue-green algal
             bloom and a 25% reduction in game fish biomass.

-------
                                                      ORNL-DWG 83-12717
1CT   -
                                              _   I
  I  I
                                                    ALGAE
CADMIUM

    ,L     -J
                                                          .K
                                                          I  I I
                                co
                                oo
                                                               10'
                          CONCENTRATION (mg L~1)
  Fig.  3.3.3.  Risk estimates  for ammonia and  cadmium over a range of
              environmental concentrations.   The 5th, mean, and
              95th percentile concentrations  associated with the
              Lurgi/Fischer-Tropsch (L) and Koppers-Totzek/Fischer-Tropsch
              (K) processes are shown at the  bottom of each graph.  The
              plotted values  are the probability of a quadrupling of the
              blue-green algal bloom and a 25% reduction in game fish
              biomass.
                                                                                          ro
                                                                                          O

-------
ORNL/TM-9120
                                  34
Table 3.3-2.
             Deterministic results of EUA (values are percent
             increases in maximum algal bloom and percent decrease in
             game fish biomass at the mean environmental concentration
             for each of the indirect liquefaction technologies)

Ammonia
Benzene
Naphthalene
Phenol
Arsenic
Mercury
Nickel
Cadmium
Lead
Endpoint
Algae
Fish
Algae
Fish
Algae
Fish
Algae
Fish
Algae
Fish
Algae
Fish
Algae
Fish
Algae
Fish
Algae
Fish
Lurgi/
Fischer-Tropsch
+306
-61
a
a
a
a
a
a
+16
-1
+102
-6
+89
-5
+368
-21
+15
-2
Koppers-Totzek/
Fischer-Tropsch
+15
-32
a
a
a
a
a
a
+6
-1
+7
-1
+32
+297
-15
+3
a
aPercent change is  less  than

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                                   35                      ORNL/TM-9120

     The lines on the graph do not pass through the origin because
there is a risk of an increase in algae (0.086) or a decrease in fish
biomass (0.038) even as the environmental concentrations of the
toxicants approach zero.  This reflects residual uncertainty in
simulating ecosystem effects.  For example, there is always some
probability of a small decrease in fish biomass due to natural
variability.
     Results for the four heavy metals show a similar pattern.  In all
of these cases, there is an upturn in the risk curves, showing
significant risks at the higher concentrations generated by one or
both of the technologies.  The increased risk of an effect to game fish
populations seems intuitively reasonable.  However, the increasing
risk of a blue-green algal bloom with increasing concentration is
counterintuitive.  Even though each of the chemicals is toxic to
the algae, the reduction in sensitive grazing organisms more than
compensates for the direct effect on phytoplankton.  This is an
example of the indirect effects that EUA is capable of showing.
     Results for ammonia and cadmium show considerably higher risk
values across the full range of environmental concentrations.  The
high values occur for both endpoints and both technologies.  The
results indicate that these two RACs should be of primary concern in
evaluating the environmental hazards of indirect coal liquefaction.
     All of the graphs illustrate the complexity of the ecosystem
responses simulated by EUA.  The relationship between concentration of
toxicant and risk is not simply linear or exponential.  The complexity
of these responses results from the nonlinear interactions considered
in the analysis.

3.3.3  Comparison of Risks Across RACs
     The importance of cadmium and ammonia is further emphasized in
Fig. 3.3.4.  The graph shows the maximum risk associated with each
of the nine RACs.  The maximum risk is defined as the risk associated
(1) with the upper 95th percentile concentration for whichever
technology showed the highest concentrations and (2) with either algal
blooms or a reduction in game fish biomass, whichever showed the higher

-------
ORNL/TM-9120                       36

risk.  Thus, the maximum risk attempts to separate RACs that never show
a significant risk from those that are significant in at least one of
the relevant calculations.
     The figure shows that  there is a very reasonable probability
that cadmium and ammonia could significantly affect the aquatic
ecosystem.  In addition, the graph indicates that the other heavy
metals (RACs 31-35) could also cause problems, although these
probabilities are associated only with the highest concentrations
produced by the Lurgi/Fischer-Tropsch process.

3.3.4  Comparison of Risks  Between Technologies
     Figure 3.3.5 compares  risks across the nine RACs for the two
technologies.  The risk values are those associated with the upper
95th percentile concentrations.  For each RAC, moving in a clockwise
direction, results are given first for the risk of algal blooms and
then for the risk of a reduction in game fish.
     Because of consistently lower environmental concentrations, the
Koppers-Totzek technology shows slightly lower risks.  However, because
of the large risks associated with ammonia (RAC 5) and cadmium (RAC 34)
and  the smaller, but not insignificant, risks that appear for the other
heavy metals (RAC 31-35), neither technology can be considered to be
free of environmental risk.

-------
                                                     ORNL-DWG   83-12715
1.0   0.8   0.6   0.4   0.2     0    0.2   0.4
0.8    1.0
 Fig. 3.3.4.  Maximum risk estimates for nine RACs (indicated by numbers).  The risk values are
            associated with algal blooms or reductions in fish biomass, whichever was larger,
            at the 95th percentile concentration of the technology with the higher
            concentration.
                                                                                         oo
                                                                                         o
                                                                                         •73

-------
ORNL/TM-9120
                                38
                                          ORNL-DWG  83-12714
                             LURGI
  1.0  0.8  0.6  0.4  0.2   0    0.2  0.4   0.6  0.8   1.0
                            KOPPERS
1.0  0.8  0.6  0.4   0.2
                                      0.2   0.4   0.6   0.8   1.0
 Figure  3.3.5.
             Comparison of  risks between  technologies.   Risks at the
             95th percentile concentration are shown first for the
             algae and then for game fish, for each of  nine RACs
             (indicated by  numbers).

-------
                                   39                      ORNL/TM-9120

                       4.  TERRESTRIAL ENDPOINTS

     The quotient method, as discussed in Sect. 3.1, consists of
dividing the ambient concentrations of toxicants by the concentration
at which some toxic effect is induced.  It is used in this section to
provide an indication of the likelihood of effects due to emissions of
the individual RACs.  The other risk analysis methods are not readily
applicable to terrestrial organisms because of the small toxicological
data base for most terrestrial taxa, the lack of standard tests and
toxicological benchmarks in the data base, and the lack of agreed-upon
standard responses for terrestrial biota.

4.1  VEGETATION
     The phototoxicity data for the gaseous and volatile RACs are
presented in Table B-l, the concentrations in ambient ground-level air
are in Tables 2.3-1 and 2.3-2, and the quotients of the ratios of these
values are in Tables 4.1-1 and 4.1-2.  The ambient concentrations are
the increment of the entire RAC to the background concentration at the
point of maximum ground-level concentration (Sect. 2.3).  It is assumed
that the RAC is composed entirely of the representative chemical and
that the background concentration is zero.  Quotients were calculated
from two classes of data:  (1) the lowest toxic concentration found in
the literature for any flowering plant species, as an indication of
maximum toxic potential of the RAC, and (2) the range across studies of
the lowest concentrations causing effects on growth or yield of the
whole plant or some plant part.  The latter set of responses is
relatively consistent and closely related to crop and forest yield.
     The worst atmospheric toxicants in the emissions of both
technologies are hydrocarbon gases (RAC 6).  This rank is biased, since
the worst-case representative chemical (ethylene) is a plant hormone,
whereas most members of this RAC are essentially inert (National
Research Council 1976).  However, since atmospheric ethylene has  caused
significant damage to crops near urban areas and near petrochemical
plants  (National Research Council 1976), the emission rate of this gas

-------
 Table 4.1-1.   Toxicity quotients  for  terrestrial plants for the Lurgi/Fischer Tropsch process.   Ambient  concentrations  in air  (annual, median, ground-level)
               and soil (soil  solution or  whole  dry soil basis) are divided by concentrations causing  reductions  in  growth, yield, or other toxic
               responses.3
Air concentration/ Range of air concentration/ Soil concentration/ Range of soil concentration/
RAC RAC name lowest toxic concentration growth-effects concentration lowest toxic concentration growth-effects concentration
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
Carbon monoxide
Sulfur oxides
Nitrogen oxides
Acid gases
Alkaline gases
Hydrocarbon gases
Formaldehyde
Volatile organochlorines
Volatile carboxylic acids
Volatile 0 & S heterocyclics
Volatile Nheterocyclics
Benzene
Aliphatic/alicyclic hydrocarbons
Mono- or diaromatic hydrocarbons
Polycyclic aromatic hydrocarbons
Aliphatic amines
Aromatic amines
Alkaline nitrogen heterocyclics
Neutral N, 0, S heterocyclics
Carboxylic acids
Phenols
Aldehydes and ketones
Nonheterocyclic organosulfur
Alcohols
Nitroaromatics
Esters
Amides
Nitriles
Tars
Respirable particles
Arsenic
Mercury
Nickel
Cadmium
Lead
Other trace elements
Radioactive materials
2.57 E-04 4.21 E-08
1.31 E-01 2.18 E-02 - 6.54 E-02
1.76 E-02 9.23 E-04 - 1.76 E-02
3.00 E-05 3.00 E-05
1.74 E-06
34 1.64 E-02 - 5.71 E-02
c c
c c
c c
d d
c c
3.93 E-07
4.77 E-12
2.81 E-05

c c
c c
c c

c c

3.64 E-03
3.03 E-07 1.67 E-06

c c
c c
c c
c c
c c


1.91 E-06





b
b
b
b
b
c
c
d
c
3.91 E-04
6.14 E-06
1.02 E-01e
c
c
c
4.72 E-10
c
8.95 E-07
3.11 E-05
2.33 E-09e
9.01 E-08
c
c
c
c
c
b
1.23e
3.04 E-07
9.84 E-02e
7.6 E-03
2.58 E-02e
b
b
b
b
b
b
b
c
c
d
c

6.14 E-06
3.16 E-02 -
c
c
c
4.72 E-ll
c

3.11 E-05


c
c
c
c
c
b
5.78 E-02e
2.79 E-09 -
1.17 E-04 -
1.69 E-04 -
2.31 E-04 -
b
b



1.02 E-01e



- 4.72 E-10











- 1.23e
3.04 E-07
9.84 E-02e
7.6 E-03
2.58 E-02e


O
70
                                                                                                                                                                    ro
                                                                                                                                                                    o
                                                                                                                                                                    -P.
                                                                                                                                                                    o
aAir, soil, and soil solution concentrations are presented in Table 2.3-1.  Toxic concentrations are presented in Appendix B.

"No accumulation in soil.

GNo emissions.

dNo phytotoxicity data.
eQuotients calculated from concentrations in soil and results of tests performed in soil.  Quotients without superscript e were calculated from
 concentrations in soil solution and results of tests performed in nutrient solution.

-------
Table 4.1-2.  Toxicity quotients for terrestrial plants for the Koppers-Totzek/Fischer-Tropsch process.  Ambient concentrations in air (annual, median,

              ground-level) and soil (soil solution or whole dry soil  basis)  are divided by concentrations causing reductions in growth,  yield, or other

              toxic responses.3
RAC RAC name
1 Carbon monoxide
2 Sulfur oxides
3 Nitrogen oxides
4 Acid gases
5 Alkaline gases
6 Hydrocarbon gases
7 Formaldehyde
8 Volatile organochlorines
9 Volatile carboxylic acids
10 Volatile 0 & S heterocyclics
11 Volatile Nheterocyclics
12 Benzene
13 Aliphatic/alicyclic hydrocarbons
14 Mono- or diaromatic hydrocarbons
15 Polycyclic aromatic hydrocarbons
16 Aliphatic amines
17 Aromatic amines
18 Alkaline N heterocyclics
19 Neutral N, 0, S heterocyclics
20 Carboxylic acids
21 Phenols
22 Aldehydes and ketones
23 Nonheterocyclic organosulfur
24 Alcohols
25 Nitroaromatics
26 Esters
27 Amides
28 Nitriles
29 Tars
30 Respirable particles
31 Arsenic
32 Mercury
33 Nickel
34 Cadmium
35 Lead
36 Other trace elements
37 Radioactive materials
Air concentration/
lowest toxic concentration
1.24 E-02
1,06 E-01
2.82 E-02
4.82 E-04
1.76 E-08
43.5
c
c
c
c
c
1.90 E-09
5.85 E-12
3.47 E-05

c
c
c
c
c
c
3.94 E-03
2.47 E-04

c
c
c
c
c


4.28 E-04





Range of air concentration/
growth-effects concentration
2.04 E-06
1.76 E-02 - 5.28 E-02
1.48 E-03 - 2.82 E-02
4.82 E-04

2.09 E-02 - 7.30 E-02
c
c
c
c
c




c
c
c
c
c
c

8.10 E-04

c
c
c
c
c








Soil concentration/
lowest toxic concentration
b
b
b
b
b

c
c
c
c
c

4.80 E-04
7.57 E-06
4.78 E-02
c
c
c
c
c
c
4.39 E-05
1.13 E-06d
3.45 E-06
c
c
c
c

b
0.12d
6.83 E-05
6.0 E-02d
1.36 E-02
1.95 E-03d
b
b
Range of soil concentration/
growth-effects concentration
b
b
b
b
b

c
c
c
c
c


7.57 E-06
4.78 E-02 -
c
c
c
c
c
c
4.39 E-05


c
c
c
c

b
5.63 E-03d -
6.27 E-07 -
7.12 E-05 -
3.01 E-04 -
1.74 E-05 -
b
b














7.75 E-02b















0.12d
6.83 E-05
6.0 E-02d
1.36 E-02
1.95 E-03d


 aAir,  soil,  solution concentrations  are  presented  in Table 2.3-2.  Toxic concentrations are presented in Appendix  B.



 bNo accumulation in soil.



 cNo emissions.



 dQuotients calculated from concentrations in  soil  and  results of tests performed in soil.  Quotients without superscript d  were calculated from

  concentrations in soil  solution and results  of  tests  performed in nutrient solution.
                                                                                                                                                                   o
                                                                                                                                                                   •yo
10
_^
ro
o

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ORNL/TM-9120                        42

should be specifically considered in the future.  The most serious
phytoxicants in air (ignoring ethylene) are S0x and N0x.  The
maximum annual  average concentrations predicted for S02 (RAC 2) from
Lurgi and Koppers-Totzek are within a tenth of those that cause visible
injury to needles of sensitive white pines, and both SO,, and N0x
(RAC 3) concentrations are greater than a hundredth of those that
reduce growth or yield of several plant species.
     Because of its ubiquity and importance as a phytotoxicant, SO,,
(RAC 2) has been well studied for its effects on crop yield.
Mclaughlin and Taylor (in press) proposed the following dose-response
relationship for yield reduction in beans as a function of SOp
exposure:
     % yield reduction = -17.4 + 29.2 (log dose in ppmh).
This empirical relationship is based on a regression of 20 points from
five field experiments on soybeans and snap beans.  Eighty percent of
the variation  in yield reduction was associated with variation in
dosage,  and the equation was significant at a = 0.0001.
      Because S0? appears to be the most serious phytotoxic air
pollutant, we  use this relationship to examine the potential effects
of full-growing-season exposure to S0« from Koppers-Totzek on
crop yield.  If we  assume a 200-d growing season for soybeans on
the  eastern site and  a  12-h exposure day, the SO,, dose at
          3
6.87 ug/m  S02 is 6.25  ppmh.  That dose results in a 5.8%
reduction in yield  by Mclaughlin and Taylor's formula.
     This predicted effect  is remarkable in that it results from an
S02  concentration that  is more than 10 times lower than the lowest
concentration  reported  to affect yield.  This anomaly  is due to the
great  length of a growing season relative to the length of experiments.
The  longest fumigation  available to Mclaughlin  and Taylor was 337 h.
Thus,  use of their formula for a full growing season requires an
extrapolation  of almost  a factor of 10 in the duration component of the
dose.  Because the experimental field fumigations are typically carried
out  in the most sensitive stage  (assumed to be  the pod-fill in the case
of beans), use of the formula for the full growing season probably
overestimates  effects.

-------
                                    43                      ORNL/TM-9120

     We might place a lower bound on the level of effect by assuming
that effects occur only during pod-fill.  If that stage is assumed to
last 30 d, the dose is 0.99 ppmh.  This is less than a quarter of the
threshold dose for effects on yield (3.92 ppmh).
     For an actual synfuels plant, this S0? emission would be added
                                                        o
to a background S02 concentration that may reach 80 u9/m  under
the current annual average ambient air quality standard and would
interact with ozone, which reaches phytotoxic levels in many areas of
the United States.  This analytical exercise demonstrates the need for
the full-season field experiments on effects of S0? and S0? + 0~
originally planned for the USEPA's National Crop Loss Assessment
Network.
     The phytotoxicity of materials deposited on the landscape is a
more complex phenomenon than that of gases and vapors.  Because the
atmospheric transport model AIRDOS-EPA has a deposition velocity of
zero for inorganic gases and does not model the formation of aerosols,
it is  assumed that RACs 1 through 5 do not accumulate in the soil.
This assumption is likely to be acceptable except in the case of SO.
deposition in forests with acid soils.  The effects of SO, deposition
in forests result from regional-scale emissions and atmospheric
processes and are therefore beyond the scope of this report.  Deposited
nongaseous RACs were assumed to accumulate in the soil over the 35-year
life of the liquefaction plant.  Losses due to decomposition
and leaching from the root zone were calculated by the terrestrial food
chain  model (Sect. 2.3).  The toxicity data (Table B-3) were primarily
derived from exposure of plants or plant parts to solutions of the
chemicals rather than to contaminated soil because few data are
available on toxicity in soil.  Whereas the results of tests done in
soil can be directly compared with concentrations in whole soil,
results of tests done in solution must be compared with a calculated
concentration in soil solution.  Because the concentration in soil
solution is more difficult to model than concentration in whole soil
and requires more simplifying assumptions, solution concentrations are
less reliable.  In addition, as with the gases and vapors, the toxicity

-------
ORNL/TM-9120                        44

data are from a wide variety of tests  and measured responses that
are not equivalent.   Finally, for most of the RACs, only one or two
chemicals have been  tested.   We cannot determine if the chemicals used
are representative of the entire RAC.
     The most phytotoxic RACs deposited in soil  are polycyclic aromatic
hydrocarbons (PAHs)  (15), arsenic (31), cadmium (34), nickel (33), and
lead (35).  The high rank of RAC 15 is suspect because benzo(a)pyrene
and some other PAHs appear to act as plant hormones and can stimulate
growth at very low concentrations.  Thus, while PAHs can modify plant
growth at concentrations as low as 0.5 ng/g soil, there is no evidence
that they reduce plant growth, even at relativity high experimental
concentrations (Edwards, 1983).  Therefore, heavy metals appear to be
the most serious soil pollutants, and  methods for predicting their
effects require attention.

4.2  WILDLIFE
     Tables 4.2-1 and 4.2-2 present the  lowest toxicity quotients for
terrestrial animals for the two technologies.  The quotients are
calculated from the lowest lethal concentration for any species and
from the  lowest concentration producing any toxic effect (Table B-3)
divided by the highest annual average ground-level concentration in
air.  Data from all species were pooled because there were not enough
data on the nonmammalian taxa for separate treatment.  Carcinogenesis
and other genotoxic effects were not included.
     Lethality is considered because it  is a consistent and frequently
determined response that has clear population implications, but all
predicted concentrations are well below  lethal levels.  The lowest
toxic concentrations include a diversity of endpoints, most of which
cannot be readily related to effects on wildlife populations but which
occur at concentrations that are as low as a ten-thousandth of lethal
concentrations.  These responses range from increased airway resistance
in 1-h exposures of guinea pigs to impaired lung and liver function
in human occupational exposures.  The most toxic RACs by this sublethal
criterion are the conventional combustion products sulfur oxides

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                                    45
                                                   ORNL/TM-9120
Table 4.2-1.
     Toxicity quotients for terrestrial animals for the
     Lurgi/Fischer-Tropsch process.  Concentrations in air
     (annual, median, ground-level) are divided by lethal
     concentrations and the lowest toxic concentrations.3
RAC
Name
Lowest lethal
concentration
Lowest toxic
concentration
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
Carbon monoxide
Sulfur oxides
Nitrogen oxides
Acid gases
Alkaline gases
Hydrocarbon gases
Formaldehyde
Volatile organochlorines
Volatile carboxylic acids
Volatile 0 & S heterocyclics
Volatile Nheterocyclics
Benzene
Aliphatic/alicyclic hydrocarbons
Mono- or di aromatic hydrocarbons
Polycyclic aromatic hydrocarbons
Aliphatic amines
Aromatic amines
Alkaline N heterocyclics
Neutral N, 0, S heterocyclics
Carboxylic acids
Phenols
Aldehydes and ketones
Nonheterocyclic organosulfur
Alcohols
Nitroaromatics
Esters
Amides
Nitriles
Tars
Respirable particles
Arsenic
Mercury
Nickel
Cadmium
Lead
5.03 E-10
4.72 E-04
1.60 E-04
4.00 E-08
5.21 E-06

b
b
b
2.62 E-ll
b
6.21 E-08
5.80 E-08
3.53 E-06

b
b
b

b

5.06 E-05
5.45 E-09
3.04 E-06
b
b
b
b
b



4.42 E-09
2.78 E-09

1.08 E-05
8.5 E-02
3.93 E-03
1.20 E-07
2.81 E-07
1.06 E-07
b
b
b
2.62 E-ll
b
6.21 E-08
3.81 E-06
6.70 E-05

b
b
b

b

1.78 E-03
8.18 E-08
5.27 E-05
b
b
b
b
b
6.28 E-02
3.06 E-05
1.12 E-07
4.42 E-09
1.39 E-06
2.56 E-05
 aAmbient  air concentrations are presented in Table 2.3-1
  concentrations  are  presented in Appendix B.
                                                  Toxic
 bNo  emissions.

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ORNL/TM-9120
                                     46
Table 4.2-2.
     Toxicity quotients  for terrestrial  animals for the
     Koppers-Totzek/Fischer-Tropsch  process.   Concentrations in
     air (annual,  median,  ground-level)  are  divided by lethal
     concentrations  and  the lowest toxic concentrations.3
RAC
Name
Lowest lethal
concentration
Lowest toxic
concentration
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
Carbon monoxide
Sulfur oxides
Nitrogen oxides
Acid gases
Alkaline gases
Hydrocarbon gases
Formaldehyde
Volatile organochlorines
Volatile carboxylic acids
Volatile 0 & S heterocyclics
Volatile Nheterocyclics
Benzene
Aliphatic/alicyclic hydrocarbons
Mono- or di aromatic hydrocarbons
Polycyclic aromatic hydrocarbons
Aliphatic amines
Aromatic amines
Alkaline N heterocyclics
Neutral N, 0, S heterocyclics
Carboxylic acids
Phenols
Aldehydes and ketones
Nonheterocyclic organosulfur
Alcohols
Nitroaromatics
Esters
Amides
Nitriles
Tars
Respirable particles
Arsenic
Mercury
Nickel
Cadmium
Lead
2.43 E-08
3.82 E-04
2.57 E-04
6.43 E-07
5.29 E-ll

b
b
b
b
b
3.01 E-10
7.12 E-08
4.35 E-06

b
b
b
b
b
b
5.48 E-05
2.65 E-06
7.92 E-06
b
b
b
b
b



7.92 E-09
1.14 E-08

5.21 E-04
6.87 E-02
6.30 E-03
2.93 E-06
2.85 E-09
1.35 E-07
b
b
b
b
b
3.01 E-10
4.68 E-06
8.25 E-05

b
b
b
b
b
b
1.93 E-03
3.97 E-05
1.37 E-04
b
b
b
b
b
2.76 E-01
6.08 E-06
2.52 E-05
7.92 E-05
5.68 E-06
3.66 E-06
 aAmbient air concentrations are presented in Table 2.3-2.
 concentrations are presented in Appendix B.

 bNo emissions.
                                                  Toxic

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                                    47                      ORNL/TM-9120

(2) and respirable particulates (30).  Although these concentrations
may constitute a locally significant increment to the background
concentration of these major pollutants, the significance of ambient
air pollution to wildlife is largely unknown.  The assumption that
protection of human health will automatically protect wildlife is not
scientifically defensible.

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ORNL/TM-9120                        48

                        5.  EVALUATION OF RISKS

5.1  EVALUATION OF RISKS TO FISH
     Table 5.1-1 lists, for each technology, the RACs determined to be
potentially ecologically significant by one or more of the three methods
employed in this report.  The significance criterion for the quotient
method is an acute-effects quotient greater than 0.01, i.e., the lowest
observed LC5Q or TLM9g less than a hundred times the estimated
environmental concentration.  For analysis of extrapolation error,
RACs are considered to be significant if the risk that the environmental
concentration may exceed the PGMATC of one or more of the reference
fish species is greater than 0.1.  For ecosystem uncertainty analysis,
RACs are considered to be significant if the risk of a 25% reduction in
game fish biomass is greater than 0.1.
     A total of nine RACs were determined to be significant for one or
more technologies.  RAC 5 (ammonia) and RAC 34 (cadmium) were the only
RACs found to be significant for both technologies and all risk analysis
methods.  RAC 4 (acid gases) was significant for both technologies
according to the quotient method and analysis of extrapolation error;
however, this RAC could not be addressed using ecosystem uncertainty
analysis.  In general, analysis of extrapolation error rated the
organic RACs substantially more hazardous, relative to the inorganic
RACs, than did the other two methods.  The reasons for these differences
in sensitivity among methods are not clear at this time.
     The exposure analyses, the significance criteria, and the methods
themselves are conservative; therefore, it would be premature to
conclude that adverse consequences would result from the contaminant
releases assessed in this report.  These nine RACs should, however,
be used in future refinements of the risk analyses and in future
toxicological and ecological research.  In addition to the RACs listed
in Table 5.1-1, there are three RACs for which nonzero exposures were
estimated but no applicable toxicity data were available: RACs 10
(volatile 0 & S heterocyclics), 19 (neutral N, 0, and S heterocyclics,
and 24 (alcohols).

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                                         49                          ORNL/TM-9120
                                                              0,0]
Table 5.1-1.  RACs determined to pose potentially significant risks to fish
              populations by one or more of three risk  analysis methods:  quotient
              method (QM), analysis of extrapolation  error  (AEE), and ecosystem
              uncertainty analysis (EUA)

Lurgi/Fischer-Tropsch process              Koppers-Totzek/Fischer-Tropsch process

 4 (acid gases) - QM, AEE                   4 (acid gases)  - QM, AEE
 5 (alkaline gases) - QM, AEE, EUA          5 (alkaline gases) - QM, AEE, EUA
 9 (volatile carboxylic acids) - AEE        9 (volatile carboxylic acids) - QM, AEE
20 (carboxylic acids, excluding            34 (cadmium) - QM, AEE, EUA
   volatiles) - AEE
31 (arsenic) - AEE
32 (mercury) - AEE, EUA
33 (nickel) - EUA
34 (cadmium) - QM, AEE, EUA

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ORNL/TM-9120                        50

     There are two ways  to compare the two technologies for ecological
risk.  It was shown,  using the toxic units approach (Sect. 3.2-3), that
the Lurgi/Fischer-Tropsch effluent has a somewhat greater potential
for acute toxicity to fish.  A similar conclusion can be reached by
inspecting Table 5.1-1.   The differences between the two processes
appear to be less important than their similarities.  For both,
conventional pollutants, especially acid gases (RAC 4) and ammonia
(RAC 5), appear to be substantially more hazardous than the complex
organic contaminants  usually associated with synfuels.

5.2  EVALUATION OF RISKS OF ALGAL BLOOMS
     Algal toxicity data were available for only ten RACs.  Moreover,
because of the diversity of experimental designs and test endpoints
used in algal bioassays, it is not meaningful  to rank the RACs using
the quotient method.   Finally, as noted in Sect. 3.1, there is no clear
distinction between acute effects and chronic  effects in algal
bioassays.
     It does appear,  however, that most of the quotients that can be
calculated are lower  for algae than for fish;  only RACs 33 and 34 would
be judged significant for any technology using the quotient method.
     Ecosystem uncertainty analysis suggests greater risks of effects
on algae than does the quotient method.  Risks of 10% or more of a
fourfold increase in  algal biomass for one or  more technologies were
estimated for six of  the nine RACs examined:  5, 31, 32, 33, 34, and
35.  The effects pathway postulated in ecosystem uncertainty analysis
is indirect rather than  direct.  All of the RACs are toxic to algae.
The increases in algal biomass are caused by reductions in grazing
intensity related to  the effects of contaminants on zooplankton and
fish.

5.3  EVALUATION OF RISKS TO VEGETATION AND WILDLIFE
     The greatest threat to terrestrial biota  from indirect coal
liquefaction appears  to  be the gases SO- (RAC 2 - sulfur oxides) and
N02 (RAC 3 - nitrogen oxides).  The concentrations of S02 for both
technologies are near phytotoxic levels.  Interactions between these

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                                    51                      ORNL/TM-9120

gases and their combined effects with background ambient pollution
deserve additional attention.  The effects of acute exposures from
"plume strikes" are also  likely to be important and deserve attention.
Air pollutants do not appear to be a threat to mammalian wildlife, but
the sensitivity of nonmammalian species is largely unknown.
     Of the materials deposited on the soil, the trace elements arsenic,
cadmium, and nickel cause the greatest concern.  However, they are
unlikely to be a problem  except when deposited on soils having
preexisting high concentrations of trace elements and chemical
properties that favor the solution phase.

5.4  VALIDATION NEEDS
     There are no uniquely  correct methods of quantifying ecological
risks.  There are several plausible ways to combine uncertainties
concerning differential sensitivities of fish taxa and acute-chronic
relationships.  Similarly,  there are many aquatic ecosystem models, and
different models produce  different estimates of uncertainty and risk.
Validation studies of the methods used in these risk analyses would
greatly  increase the credibility of the results.
     There are two ways in  which these synfuels risk analyses can be
validated.  A specific  validation would  involve building a synfuels
industry and monitoring the resulting environmental effects.  A generic
validation would involve  checking the assumptions and models  used  in
the risk analyses against the results of field and laboratory studies.
Given the current state of  the  synfuels industry, a generic validation
seems more practical.
     Generic validation of  the  environmental risk analysis methods
would begin with an examination of the capability of existing published
evidence to support or refute the models  or  their component
assumptions.  To a certain  extent, this has  been done by  us as a  part
of our methods development  (e.g.,  Suter et  al.  1983,  Suter  and Vaughan
1984),  and by others for  generally  used models  such  as  the  Gaussian
plume atmospheric dispersion model.   However,  there  has  been  no
systematic consideration  of such  major  assumptions  as  the validity of

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ORNL/TM-9120                        52

hydroponic phytotoxicity studies nor of the risk analysis methodology
as a whole.  The results of validation studies would indicate not only
the level  of confidence that can be placed  in  environmental  risk
analyses,  but also the research needed for  further development and
validation of risk analysis methods.

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                                    53                     ORNL/TM-9120

                          6.  ACKNOWLEDGMENTS

     The authors thank R. E. Millemann and J. W. Webb for their
thorough reviews of this report.  We also thank S. G. Hildebrand and
A. A. Moghissi for their support and encouragement in this project.

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ORNL/TM-9120                        54

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                                    57                      ORNL/TM-9120

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-------
ORNL/TM-9120                        60

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                                    65                      ORNL/TM-9120

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 ORNL/TM-9120                       66

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                                    67                      ORNL/TM-9120

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           69                      ORNL/TM-9120
     APPENDIX A
Aquatic Toxicity Data

-------
Table A-l.  Acute toxicity of synfuels chemicals to aquatic animals.
RAC
Representative
 chemical(s)
  Test
organism3
             Duration
Test type      (h)
Concentration
   (mg/L)
                                                                                                   Notes
                                                                                                                        Reference
 1   Carbon monoxide

 2   Sulfur oxides



 3   Nitrogen oxides



 4   H2S
     Ammon i a
  6    Heptane

  7    Formaldehyde


  8    Carbon tetrachloride




      Chloroform




  9    Acetic  acid
Scud (Gammarus
 pseudolimnaeus)
Bluegill
 (Adults)
 (Juveniles)
 (Fry, 35-day-old)
 (Eggs)
Northern pike
 (Eggs)
 (Fry)
                     Rainbow trout
                      (Fry, 85-day-old)
                      (Adults)
                     Rainbow trout
                     Rainbow trout
                     Rainbow trout (Fry)
                      (Fingerlings)

                     Mosquitofish

                     Several fish sp.
                     Daphnia magna
                     Fathead minnow
                     Bluegill
                     Bluegill

                     D. magna
                     BluegTTT
                     Bluegill
                     Rainbow trout

                     Fathead minnow
                     Mosquitofish
                                                      TLm
                                                      TLm
                                                      TLm
                                                      TLm

                                                      TLm
                                                      TLm
                                                      TLm
                                                      TLm

                                                      LC5°
                                                      ir50
                                                      [Cr50
                                                      LC50

                                                      TLm
                        5°
                      LC;
                        '50
                      LCi
                      LC;
                      LC;
                      LC;
                                                      TLm
                                                             96
                                                             96
                                                             96
                                                             96
                                                             72

                                                             96
                                                             96
                                     24
                                     24
                                     24
                                     24
                                     24
                                     24

                                     96

                                     24
               48
               96
               96
               96
               96
               96
               96

               96
               96
                                                                           0.022
                                                   0.0448
                                                   0.0478
                                                   0.0131
                                                   0.0190
                                                   0.034-
                                                   0.037
                                                   0.009-
                                                   0.026
                             0.068
                             0.097
                             0.50
                             0.47
                             0.2
                             0.2

                             4,924

                             50-120
    35.2
    43.1
    27.3
    125.0

    28.9
    100.0
    115.0
    43.8

    88.0
    251.0
                                                                                     No  toxicity  data

                                                                                     Aquatic  problems
                                                                                     associated with pH,
                                                                                     not direct toxicity

                                                                                     Aquatic  problems
                                                                                     associated with pH,
                                                                                     not direct toxicity
                                       Flow-through  test
                                       Flow-through  test
                                       Flow-through  test
                                       Flow-through  test

                                       DO=2-6  ppm
                                       DO=2-6  ppm
                                                             Flow-through test
                                                                                  Oseia  and Smith,  1974
                                    Smith et al.,  1976
                                    Smith et al.,  1976
                                    Smitn et al.,  1976
                                    Smith et al.,  1976

                                    Adelman  and  Smith,  1970
                                    Adelman  and  Smith,  1970
                                                                                     Rice and Stokes,  1975
                                                                                     Kice and Stokes,  1975
                                                                                     Herbert and Shurben, 1963
                                                                                     Lloyd and Orr,  1969
                                                                                     LIFAC, 1970
                                                                                     EIFAC, 1970

                                                                                     Wallen et al.,  1957

                                                                                     National Research
                                                                                      Council, 1981

                                                                                     U.S. EPA, 1980a
                                                                                     U.S. EPA, 1980a
                                                                                     U.S. EPA, 1980a
                                                                                     U.S. EPA, 1980a

                                                                                     U.S. EPA, 1980b
                                                                                     U.S. EPA, 1980b
                                                                                     U.S. EPA, 1980b
                                                                                     U.S. EPA, 1980b

                                                                                     Mattson et al, 1976
                                                                                     Wallen et al., 1957
                                                                                                                             I
                                                                                                                             UD
                                                                                                                                                             ro
                                                                                                                                                             o

-------
Table A-l. (continued).
Representative
KAC chemical (s)
10 Volatile O&S
heterocyclics
11 Pyridine



12 Benzene





13 Cyclohexane






Indan
14 Toluene






Naphthalene




Xylene

1 5 Anthracene

Test
organism3


Ciliate (Tetrahymena
pyriforma')
D. magna
IT. magna
D. magna

D. magna
Fathead m i n n ow
Fathead minnow
Mosquitofish
Rainbow trout
Fathead minnow
Fathead minnow

Fathead minnow

Bluegill

Fathead minnow
D. magna
Fathead minnow

Fathead minnow

Bluegill

Bluegill
D. magna
U. magna
Fathead minnow
Fathead minnow

Rainbow trout
Fathead minnow
Goldfish


Test type


LC,50

LC50
LC50
LC50

LC5°
LC30
LC50

LC50
TLm

TLm

TLm

LC50
LC50
TLm

TLm

TLm

LC50
LC50
LC50
'-'-50

LC50
TLm
TLm


Duration
(h)


72

48
48
48

48
96
96
96
96
96
96

96

96

96
48
96

96

96

96
48
48
48
96

96
96
96


Concentration
(mg/L)


1211.8

1165
1755
203.0-
620.0
426.0
32.0
15.1
1300.0
5.3
93.0
42.3

32.7

34.7

14.0
39.22
42.3

34.3

24.0

12.7
2.16
8.57
3.14
4.90-
8.90
2.30
42.0
17.0


Notes
No toxicity data

50% growth
inhibition





Flow-through test

Flow-through test

Hard water

Soft water

Soft water


Hard water

Soft water

Soft water




2 tests




Not toxic to fish,

Reference


Schultz et al., 1980

Canton and Adema, 1978
Canton and Adema, 1978
U.S. EPA, 1980c

Canton and Adema, 1978
U.S. EPA, 1980c
DeGraeve et al., 1982
Wallen et al., 1957
U.S. EPA, 1980c
Mattson et al . , 1976
Pickering and
Henderson, 1966a
Pickering and
Henderson, 1966a
Pickering and
Henderson, 1966a
Mattson et al., 1976
Millemann et al . 1984
Pickering and
Henderson, 1966a
Pickering and
Henderson, 1966a
Pickering and
Henderson, 1966a
U.S. EPA, 1980d
Millemann et al., 1984
U.S EPA, 1980e
Millemann et al., 1984
U.S EPA, 1980e

U.S EPA, 1980e
Mattson et al., 1976
Brenniman et al., 1976
McKee and Wolf, 1963
O
72
\ —
— t
1
ro
o













— i



















even in super-
saturated solutions

-------
Table A-l.  (continued).
RAC






16
17



18








19

20
21












Representative
chemical (s)
Phenanthrenc



Fluorantnene

Aliphatic amines
Aniline


3, 5-Dimethyl aniline
Quinoline




2-Methylquinoline

2,6-Dimethylquinol ine

Neutral N,0,S
heterocyclics
Benzoic acid
Phenol









2-Methyphenol


Test
organism8
D. magna
ET. magna
Rainbow trout
(Embryo- larvae)
D. magna
Bluegill

D. magna
Daphnia cucullata
D. magna
J). magna
Ciliate (T. pyriforma)

D. magna
Fathead minnow
Fathead minnow

Ciliate (T. pyriforma)

Ciliate (]_. pyriforma)



Mosquitof ish
D. magna
TT. magna
U. magna (Young)
Copepod (Mespcyclops
leukarti)
Fathead minnow
Fathead minnow

Bluegill
Rainbow trout

D. magna
IT. magna
Fathead minnow
Fathead minnow

Test type
LCso
LCso


LC50
LCso

LC50
LC50
50
50
LC50

LCso


EC50

"SO



TLm
LC50

TLm
LC50

50
50

LC50
LC50

LCso
TLm
TLm

Duration
(h)
48
48
96

48
96

48
48
48
48
72

48
48
96

72

72



96
48

50


48
96




48
48
96
96

Concentration
(mg/L)
0.75
1.10
0.04

325.0
3.9

0.65
0.68
0.58
1.29
125.7

30.28
1.50
46.0

48.7

33.0



180
19.79
9.6
7.0
108.0

25.6
24.0-
67.5
11.5-
23.9
8.9-
11.6
9.2
23.5
12.55
13.42

Notes






No toxicity data




50% growth
inhibition



50% growth
inhibition
50% growth
inhibition
No toxicity data







4 tests

6 tests
2 Flow-through
tests
Soft water
Hard water

Reference
Millemann et al., 1984
Parkhurst, 1981
Birge and Black, 1981

U.S. EPA, 1980f
U.S. EPA, 1980f

Canton and Adema, 1978
Canton and Adema, 1978
Millemann et al., 1984
Millemann et al., 1984
Schultz et al., 1980

Millemann et al., 1984
Millemann et al., 1984
Mattson et al., 1976

Schultz et al., 1980

Schultz et al., 1980



Wallen et al., 1957
Millemann et al., 1984
U.S. EPA, 1980g
Oowden and Bennett, 1965
U.S. EPA, 1980g

Millemann et al., 1984.
U.S. EPA, 1980g

U.S. EPA, 1980g
U.S. EPA, 1980g

U.S. EPA, 1980g
U.S. EPA, 1980g
Pickering and
Henderson, 1966a
Pickering and
Henderson, 1966a















•vj
co












o
73
•z.
-H
2
1

ro
0



-------
Tabl
RAC










22













23

24
25
26









e A-l . (continued) .
Representative
chemical (s)


4-Methylphenol
Mixed cresol isomers
2,4-Dimethylphenol



3, 4-Di methyl phenol
2, 5-Ui methyl phenol
Acrolein










Acetaldehyde

Acetone
Nonheterocylic
organo sulfur
Alcohols
Nitroaromatics
Di-2-ehtylhexyl
phthalate
Diethyl phthalate

Butylbenzl phthalate






Test
organism3
Bluegill

Fathead minnow
Aquatic life
D. magna
Fathead minnow
(Juvenile)
Bluegill
Fathead minnow
D. magna
D. magna
D. magna
Mosquitof ish

Bluegill
Bluegill
Brown trout

Rainbow trout

Largemouth bass
Bluegill

D. magna





D. magna
D. magna
Bluegill
D. magna
D. magna
Fathead minnow

Fathead minnow
Bluegill

Test type
TLm

TLm
TLm
LC50

LC50
LC50
50
50
50
LC50
LC50

LC5Q
LC50
LC50

LC5Q

LC50
LC50

LC50





LC50
LC50

LC5Q
LC50
LC50

LC50


Duration
(h)
96

96
96
48

96
96
96
48
48
48
48

96
96
24

24

96
96

48









48
96

96


Concentration
(mg/L) Notes
20.78 Soft water

19.0
1.0-10.0
2.12

16.75 Flow-through test
7.75
14.0
0.96
0.057
0.080
0.061

0.100
0.090
0.046

0.065

0.160
53.0

12,600
No toxicity data

No toxicity data
No toxicity data

11.1
52.1
98.2
92.3
3.7
5.3 160 mg/L hardness
as CaC03
2.1 40 mg/L hardness
43.3

Reference
Pickering and
Henderson, 1966a
Mattson et al., 1976
Kingsbury et al., 1979
U.S. EPA, 1980h

U.S. EPA, 1980h
U.S. EPA, 1980h
Mattson et al., 1976
Millemann et al . , 1984
U.S. EPA, 19801
U.S. EPA, 1980i
National Research
Council, 1981
U.S. EPA, 19801
U.S. EPA, 19801
National Research
Council, 1981
National Research
Council, 1981
U.S. EPA, 19801
National Research
Council, 1981
Canton and Adema, 1978





U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980J
Gledhill et al., 1980
Gledhill et al . , 1980

Gledhill et al., 1980
U.S. EPA, 1980J
ORNL/TM-1

-------
Table A-l.  (continued).
Representative
RAC chemical (s)


Di-n-butyl phthalate




27 Amides
28 Acrylonitrile





29 Tars
30 Respirable particles
31 Arsenic








32 Mercury (inorganic)






Methylmercury

Test
organism3
Bluegill
Rainbow trout
Scud (G. pseudo-
limnaeus)
Fathead minnow
Bluegill
Rainbow trout

D. magna
Fathead minnow
Fathead minnow
Fathead minnow
Bluegill
Bluegill


D. magna
TJ. magna
TTaphnia pulex
Stonefly (Pteronarcys
californica)
Fathead minnow
(Juvenile)
Bluegill (juvenile)
Bluegill
Rainbow trout
Brook trout
D. magna

Stonefly (Acroneuria
lycorius)
Fathead minnow
Rainbow trout
Coho salmon
Rainbow trout
(Juvenile)
Rainbow trout
Rainbow trout (Sac fry)
(Fingerling)
(Juvenile)
Brook trout
(Juvenile)
(Yearling)
Test type
LCso
LC50
LC50

LC50
LC50
LCso

LC50
LC50
LC50
LC50
LCso
LC50


TLm
Ef50
EC50
LC50


iLr50
LC50
LC50
LC50
LC50
LC50

TLm

LC50
LC50
ic50
LC50
LC50
LC50
LC5°
LC50
LC5°
LC50
Duration
(h)
96
96
96

96
96
96


96
96
96
96



48
48
48
96


96
96


93
48

96




96
96
96
96
Concentration
(mg/L)
1.7
3.3
2.1

1.3
0.73
6.47

7.55
14.3
18.1
10.1
11.8
10.1


7.4
5.28
1.04
22.04


15.66
41.76
15.37
13.34
14.96
0.005

2.0

0.19
0.31
0.24
0.155-
0.4
0.03
0.024
0.042
0.025
0.084
0.065
Notes







No toxicity data



Flow-through test


No aquatic emissions
No aquatic emissions

Immobilization
Immobilization



Flow-through test
Flow-through test


Flow-through test






4 tests

Flow-through test
Flow-through test
Reference
Gledhill et al., 1980
Gledhill et al . , 1980
Mayer and Sanders, 1973

Mayer and Sanders, 1973
Mayer and Sanders, 1973
Mayer and Sanders, 1973

U.S. EPA, 1980k
U.S. EPA, 1980k
U.S. EPA, 1980k
U.S. EPA, 1980k
U.S. EPA, 1980k
U.S. EPA, 1980k


Hohreiter, 1980
Anderson, 1946
Sanders and Cope, 1966
Sanders and Cope, 1968


Cardwell et al . , 1976
Cardwell et al., 1976
U.S. EPA, 19801
U.S. EPA, 19801
Cardwell et al., 1976
Biesinger and
Christensen, 1972
Warnick and Bell, 1969

U.S. EPA, 1980m
Hohreiter, 1980
U.S. EPA, 1980m
U.S. EPA, 1980m
Hohreiter, 1980
Hohreiter, 1980
Hohreiter, 1980
U.S. EPA, 1980m
McKim et al., 1976
McKim et al . , 1976
                                                                                                                                                      en
                                                                                                                                                      O
                                                                                                                                                      70
                                                                                                                                                      to

                                                                                                                                                      ro
                                                                                                                                                      O

-------
iaoieA-1. icontinuedj.
Representative Test
RAC chemical (s) organism3
33 Nickel D. magna

D. magna
Mayfly (Ephemerella
subvaria]
Stonefly (A. lycorius)
Damselfly
(Unidentified)
Midge
(Chironomus sp.)
Caddisf ly
(Unidentified)
Fathead minnow


Fathead minnow

Bluegill

Bluegill

Rainbow trout
Fish sp., general
Fish sp., general

34 Cadmium D. magna
D". magna
D. magna
Mayfly (Ephemerella
grandis grandis)
Mayfly (E. subvar i a )
Stonefly (Pteronarcella
badia)
Damselfly
(Unidentified)
Midge
(Chironomus) Caddisfly
(Unidentified)
Fathead minnow

Fathead minnow

Bluegill

Bluegill
Rainbow trout
(swim-up and parr)


Test type
LC50

LC50

TLm
TLm

TLm

TLm

TLm
LCsf)


TLm

TLm

TLm

LC50

LC50

LC50
LC50

TLm

TLm
TLm


TLm
TLm
TLm

TLm

TLm

TLm

LC50




Duration
(h)




96
96

96

96

96



96

96

96

96
96
96




96

96
96


96
96
96

96

96

96


96



Concentration
(mg/L)
1.81

2.34

4.0
33.5

21.2

8.6

30.2
4.58-
5.18

25.0

5.18-
5.36
39.6

35.5
4.6-9.8
39.2-
42.4
0.0099
0.033
0.049
28.0

2.0
18.0


8.1
1.2
3.4

0.630

72.6

1.94

21.1
0.001-
0.0013


Notes
Hardness:51
(mg/L as CaC03)
Hardness: 100

Hardness:42
Hardness :40

Hardness: 50

Hardness: 50

Hardness: 50
Hardness:20
2 Flow-through
tests
Hardness:210
Flow-tnrough test
Hardness:20
2 tests
Hardness: 360

Flow-through test
Soft water
Hard water

Hardness: 51
Hardness: 104
Hardness:209


Hardness: 54



Hardness: 50
Hardness: 50
Hardness: 50

Hardness: 20

Hardness: 360

Hardness: 20

Hardness: 207
Hardness: 23
2 Flow-through
tests

Reference
U.S. EPA, 1980n

U.S. EPA, 1980n

Warnick and Bell, 1969
Warnick and Bell, 1969

Rehwoldt et al., 1973

Rehwoldt et al . , 1973

Rehwoldt et al., 1973
U.S. EPA, 1980n


Pickering, 1974

Pickering and
Henderson, 1966b
Pickering and
Henderson, 1966b
Hale, 1977
Hohreiter, 1980
Hohreiter, 1980

U.S. EPA, 1980o
U.S. EPA, 1980o
U.S. EPA, 1980o
Clubb et al., 1975

Warnick and Bell, 1969
Clubb et al., 1975


Rehwoldt et al., 1973
Rehwoldt et al., 1973
Rehwoldt et al., 1973

Pickering and
Henderson, 1966b
Pickering and
Henderson, 1966b
Pickering and
Henderson, 1966b
U.S. EPA, 1980o
U.S. EPA, 1980o


ORNL/TM-
10
ro
o

















^.
CT




























-------
Table A-l.  (continued).
Representative Test
RAC chemical (s) organism3
Rainbow trout

Carp
Chinook salmon
(Parr)
Brook trout

Green sunfish
Pumpkin seed
35 Lead 0. magna
0. magna
Fathead minnow
Fathead minnow

Bluegill

Bluegill

Rainbow trout (Fry)
Rainbow trout

Rainbow trout
Rainbow trout
Brook trout
36 Fluorine D. magna
Goldfish
Goldfish

Goldfish

Rainbow trout

Test type
LC5o

LC50
LC50

LC50

LCcn
LC50
LC50
LC^O
TLm

TLm

TLm

LCcg
LC50

LC50

LC50






TLm

Duration
(h)
96









96
96

96

96

96
96

96
96
96
48
96
12-29

60-102

240

Concentration
(mg/L)
0.00175

0.24
0.0035

0.0024

2.84
1.5
0.612
0.952
2.4
482.0

23.8

442.0

0.6
1.17

1.0
8.0
4.1
270.0
120.0
1000.0

1000.0

2.3-7.5

Notes
Hardness:31
Flow-through test
Hardness: 55
Hardness:23

Hardness :44
(sodium sulfate)
Hardness :20
Hardness:55
Hardness:54
Hardness: 110
Hardness:20
Hardness: 360

Hardness :20

Hardness: 360


Hardness:32
Flow-through test


Hardness: 44
"Toxic threshold"
100% kill
100% kill in soft
water
100% kill in hard
water
TLm varies with
temperature
Reference
U.S. EPA, 1980o
U.S. EPA, 19800
U.S. EPA, 1980o
U.S. EPA, 1980o

U.S. EPA, 1980o

U.S. EPA, 1980o
U.S. EPA, 1980o
U.S. EPA, 1980p
U.S. EPA, 1980p
U.S. EPA, 1980p
Pickering and
Henderson, 1966b
Pickering and
Henderson, 1966b
Pickering and
Henderson, 1966b
Hohreiter, 1980
Davies et al., 1976

Hohreiter, 1980
U.S. EPA, 1980p
U.S. EPA, 1980p
Hohreiter, 1980
Hohreiter, 1980
Hohreiter, 1980

Hohreiter, 1980

Angelovic et al . , 1961

 aLatin binomials are listed in Appendix C.
                                                                                                                                                     PO
                                                                                                                                                     O

-------
Table A-2. Chronic toxicity of synfuels chemicals to aquatic animals.
RAC
8
12
14
21
22
26
28
31
32
Representative
chemical (s)
Carbon tetrachloride
Chloroform
Benzene
Naphthalene
Phenol
2,4-Oimethylphenol
Acrolein
Di-2-ethylhexyl
pnthalate
Butyl benzyl
phthalate
Acrylonitrile
Arsenic
Mercuric chloride
Methylmercuric
chloride
Test
organism8
Fathead minnow
Rainbow trout
Rainbow trout
Rainbow trout
Daphnia magna
Fathead minnow
Fathead minnow
Fathead minnow
Fathead minnow
D. magna
D. magna
Fathead minnow
D. magna
TTainbow trout
D. magna
Fathead minnow
D. magna
Fathead minnow
D. magna
D. magna
Bass sp., general
Pink salmon
D. magna
D. magna
Fathead minnow
Brook trout
Duration
Test type (d)
Embryo-larval
Embryo-larval 27
Embryo-larval 27
Embryo 23
Life cycle
Embryo-larval
Embryo-larval
Embryo-larval
Embryo-larval
Life cycle
Life cycle
Life cycle
Life cycle
Embryo-larval
Life cycle
Embryo-larval
Life cycle
LC50 30
Life cycle
TLm 21
10
10
Life cycle
Life cycle
Life cycle
Concentration
(mg/L) Notes
>3.4
1 .2 200 mg/L water
hardness
2.0 50 mg/L water
hardness
10.6 40% teratogenesis
>98.0
0.62
2.56
2.191
2.475
0.024
0.034 Survival reduced
after 64 days
0.021
<0.003
0.008
0.44
0.22
>3.6
2.6
0.912
2.85
7.60 Toxic
5.00 Lethal
0.001 - 4 tests
0.0025
0.001
0.00023 92% dead, 3 months
0.00052
Reference
U.S. EPA, 1980a
U.S. EPA, 1980b
U.S. EPA, 1980b
U.S. EPA, 1980b
U.S. EPA, 1980c
U.S. EPA, 1980e
U.S. EPA, 1980g
U.'S. EPA, 1980h
U.S. EPA, 1980h
U.S. EPA, 1980i
National Research
Council, 1981
U.S. EPA, 1980i
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980k
U.S. EPA, 1980k
U.S. EPA, 19801
Hohreiter, 1980
Hohreiter, 1980
Hohreiter, 1980
U.S. EPA, 1980m
U.S. EPA, 1980m
Hohreiter, 1980
U.S. EPA, 1980m
o
73
•z.
r~
— 1
i
ro
o



00





-------
Table A-2.  (continued).
Representative Test
RAC chemical (s) organism3
33 Nickel








34 Cadmium








3b Lead









36 Fluorine




D_. magna

D. magna
Caddisfly
(Clistoronia
magnifica)
Fathead minnow
Fathead minnow
Rainbow trout
D. magna
D. magna
IT. magna
Midge (fanytarsus
dissimilis)
Fathead minnow
Bluegill
Brook trout
Brook trout
0. magna
D. magna
Stonefly (Acroneuria
lycoriasl
Mayfly (Ephemerella
subvarTa)
Caddisfly (Hydropsyche
betteri)
Bluegi 1 1
Rainbow trout
Rainbow trout
Rainbow trout

Rainbow trout


Duration
Test type (d)
Life cycle

Life cycle


Life cycle
Embryo-larval
Life cycle
Embryo- larval
Life cycle
Life cycle
Life cycle


Life cycle
Life cycle
Embryo-larval
Embryo-larval
Life cycle
Life cycle
LC50 14

LC50 7

LC50 7
Embryo- larval
Embryo-larval
Embryo- larval
21

21


Concentration
(mg/L) Notes
0.015

0.123


0.465
0.109
0.527
0.350
0.00015
0.00021
0.00044

0.0031
0.046
0.050
0.0017
0.0092
0.012
0.128
64.0

16.0

32.0
0.092
0.019
0.102
113.0

250.0


Hardness: 51
(mg/L as CaC03)
Hardness: 105


Hardness: 50
Hardness: 44
Hardness: 210
Hardness: 50
Hardness: 53
Hardness: 103
Hardness: 209


Hardness: 201
Hardness: 207
Hardness: 36
Hardness: 187
Hardness: 52
Hardness: 151





Hardness: 41
Hardness: 28
Hardness: 35
100% kill,
45 mg/L CaC03
100% kill,
320 mg/L CaCO?,
yearling trout
Reference
U.S. EPA, 1980n

U.S. EPA, 1980n


U.S. EPA, 1980n
U.S. EPA, 1980n
U.S. EPA, 1980n
U.S. EPA, 1980n
U.S. EPA, 19800
U.S. EPA, 19800
U.S. EPA, 1980o

U.S. EPA, 1980o
U.S. EPA, 19800
U.S. EPA, 19800
U.S. EPA, 19800
U.S. EPA, 1980o
U.S. EPA, 1980p
U.S. EPA, 1980p
Hohreiter, 1980

Hohreiter, 1980

Hohreiter, 1980
U.S. EPA, 1980p
U.S. EPA, 1980p
U.S. EPA, 1980p
Hohreiter, 1980

Hohreiter, 1980


 aLatin binomials are listed in  Appendix  C.
ro
o

-------
Table A-3.  Toxicity of synfuels chemicals to algae.
Representative
RAC chemical (s)
12 Benzene

14 Toluene






Naphthalene





15 Fluoranthene





17 Aniline




p-Toluidene




21 Phenol











2,4-Dimethylphenol

Test
organism Test type
Chlorella vulgaris ECi;n

C_. vulgaris EC5Q

Selenastrum
capricornutum ECt;n



C. vulgaris EC50.


Chalamydomonas
angulosa ECgi

S. capricornutum EC^n

S. capricornutum EC^n



Agmenel lum
quadruplicatum



A. quadruplicatum

Coccochloris elabens
Eucapsis sp.
Oscillator! a williamsii
S. capricornutum




S. capricornutum ECt;n

Nitzschia linearis ECi;fi

Chlorella pyrenoidosa ECmn

C. vulgaris EC£Q
T. pyrenoidosa ECmn

Duration Concentration
(h) (mg/L) Notes
48 525.

0

24 245.0


96 433.



48 33.



24 34.

96 54.

96 54.




0.



0.

0.
0.
0.
20.




24 40.

120 258.

48 1500.

80 470.
48 500.



0



0



4

4

6




010



010

010
010
010
0




0

0

0

0
.0

Reduction in cell
numbers
Reduction in cell
numbers

Reduction in cell
numbers and
chlorophyll a
production
Reduction in
extrapolated
cell numbers

61% mortality of
cells
Reduction in eel 1
numbers
Reduction in
chlorophyll a
production


Diffusion from disk
onto algal lawn
inhibited growth
for 3-7 days
Same as above
for all 4 species



Growth inhibition of
12-66% depending on
time (2-3 d) and
temperature (20,
24, 28°C)
Reduction in cell
numbers
Reduction in cell
numbers
Complete destruction
of chlorophyl 1
Growth inhibition
Complete destruction
of chlorophyll
Reference
U.S.


.U.S.




U.S.






U.S.



U




.S.

U.S.

U.





.S.




EPA,

EPA,


EPA,



EPA,



EPA,

EPA,

EPA,




Batterton
1980c

1980d


1980d



1980e



1980e

1980f

1980f




et al.,
— )
1
ro
0


















00
o


1978






Batterton


et al . ,



1978



U




U

U

U

U
U




.S.




.S.

.S.

.S.

.S.
.s.




EPA,




EPA,

EPA,

EPA,

EPA,
EPA,




1980g




1980g

1980g

1980g

1980g
1980g



















-------
TaDle A-3.   (continued).
RAC
26
31
32
33
34
Representative
chemical(s)
Butyl benzyl phthalate
Uimethyl phthalate
uiethyl phthalate
Arsenic
Mercuric chloride
Methylmercuric
chloride
Nickel
Cadmium
Test
organism Test type
S. capricornutum ECi;r)
S. capricornutum ECi;n
Microcystis aeruginosa ECsg
Navicula pelliculosa ECqn
S. capricornutum ECso
S. capricornutum ECc;n
S. capricornutum ECc;n
S. capricornutum EC^n
Cladophora, Spirogyra,
Zygnema sp. EC-|go
Scenedesmus sp.
C. vulgaris ECc,o
Spring diatom EC5Q
assemblages
Coelastrum
microporum ECi;n
Chlamydomonas,
Chlorella,
Haematococcus,
Scenedesmus sp.
Phormidium ambiguum EC-j^
Scenedesmus
Scenedesmus sp.
Scenedesmus sp.
C. pyrenoidosa
C. vulgaris ECso
?. capricornutum
Mixed species
Duration
(h)
96
96
96
96
96
96
96
96
336
96
768
2
336
Concentration
(mg/L)
0.11
0.13
1000.0
0.60
42.7
39.8
90.3
85.6
2.32
20.0
1.03
0.08
2.4-4.8
0.1-0.7
0.5-10.0
1.5
0.0061
0.05-0.5
0.25
0.06
0.05
0.005
Notes
Reduction in
chlorophyll a
Reduction in eel 1
numbers
Reduction in eel 1
numbers
Reduction in eel 1
numbers
Reduction in
chlorophyll a
Reduction in eel 1
numbers
Reduction in
chlorophyll ji
Reduction in cell
numbers
100% kill
Threshold effects
Cell division
inhibition
Reduction in photo-
synthetic activity
Growth inhibition
Growth reduced in
all cultures in
water with 50 mg/L
CaC03
Growth inhibition
Threshold effects
Reduction in eel 1
numbers
Growth inhibition
Growth inhibition
Growth reduction
Growth reduction
Population reduction
Reference
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 1980J
U.S. EPA, 19801
Cushman et al . ,
1977
U.S. EPA, 1980m
U.S. EPA, 1980m
U.S. EPA, 1980m
U.S. EPA, 1980n
Cushman et al . , 1977
Cushman et al., 1977
U.S. EPA, 19800
Cushman et al., 1977
U.S. EPA, 19800
U.S. EPA, 19800
U.S. EPA, 19800
U.S. EPA, 19800
                                                                                                                                                              CO

-------
                                                                                                                                                             i
                                                                                                                                                             <£>
                                                                                                                                                             ro
                                                                                                                                                             o
Table A-3.   (continued).
Representative Test
RAC chemical (s) organism
35 Lead Ankistrodesmus sp.
(.morel la sp.
Scenedesmus sp.
Selenastrum sp.
Anabaena sp.
Chlamydomonas sp.
Cosmarium sp.
Navicula sp.
Scenedesmus sp.
Test type
Ff24
Ef53
Ff35
Ff52
EC50
EC50
EC50
EC50
Duration Concentration
(h) (mg/L)
1
0
0
0
24 15
24 17
24 5
24 17
2
.00
.50
.50
.50
.0-26.0
.0
.0
.0-28.0
.5
Notes
Growth inhibition
Growth inhibition
Growth inhibition
Growth inhibition
Reduction In COj
fixation
Reduction in C02
fixation
Reduction in C02
fixation
Reduction in COj
fixation
Threshold effects
Reference
U.S. EPA,
U.S. EPA,
U.S. EPA,
U.S. EPA,
'U.S. EPA,
U.S. EPA,
U.S. EPA,
U.S. EPA,
Cushman et
1980p
1980p
1980p
1980p
1980p
1980p
1980p
1980p
al., 1977
                                                                                                                                                             00
                                                                                                                                                             ro

-------
             83                      ORNL/TM-9120
       APPENDIX  B
Terrestrial Toxicity Data

-------
Table B-l.  Toxicity of chemicals  in air to  vascular  plants.
Representative Test
RAC chemical organism3
1 Carbon monoxide Grapefruit

Red clover

Several species

Popinac

2 Sulfur dioxide0 Barley
Durum wheat
Alfalfa
Tobacco, Bel W3
Cocksfoot
Broadbean

White pine

Norway spruce
3 Nitrogen dioxide Wheat
Bush bean
Spruce

Endive
Carrot
Tobacco, bean,
tomato, radish,
oat, soybean
Cocksfoot and
meadow grass
4 Hydrogen sulfide Green bean
Green bean

Alfalfa
Lettuce
Douglas-fir
Sugar beets

Exposure
Duration
Response (hours)
-C02 uptake

-20% N fixation

-Growth

Defoliation

-44% yield
-42% yield
-26% foliage
-22% foliage
-40% total wt.
Reduced net
photosynthesis
Needle damage
threshold
-25% volume growth
-12% straw yield
-27% yield
-7% linear growth

-37% yield
-30% yield
Visible foliar
injury

-Yield

-20% photosynthesis
-25% whole plants
yield




552

24

72/wk
72/wk
100
100
2070
8

6

1680
334
639
1900

620
357
4


2070

3
64

-39% yield 672-840
-66% yield
-weight and
-38% sugar
+43% sugar
2112
5904
3216
3216
Concentration
(ug/m3) Notes'5
1.8 EOS

1.1 E05

1.1 E07

2.3 E07

3.9 E02
3.9 E02
1.3 E02
1.3 E02
1.78 E02
9.2 E01

6.5 E01

1.3 E02
2 EOS
2 EOS
2-3 EOS

2 £03
4 EOS
3.8 £03


2.1 E02

7.0 E02
2.8 E02

4.2 E02
4.2 E02
4.2 £02
4.2 E02
4.2 E01
detached leaves







field, growing season
field, growing season
5 hr/d, 5 d/wk, 4 wk
5 hr/d, 5 d/wk, 4 wk
103.5 hr/wk, 20 wk


sensitive clone




-17% linear growth in
following year


Reference
National Research
Council, 1977a
National Research
Council, 1977a
National Research
Council, 1977a
National Research
Council, 1977a
U.S. EPA, 1982
U.S. EPA, 1982
U.S. EPA, 1982
U.S. EPA, 1982
U.S. EPA, 1982
U.S. EPA, 1982

U.S. EPA, 1982

U.S. EPA, 1982
Zahn, 1975
Zahn, 1975
Zahn, 1975

Zahn, 1975
Zahn, 1975

























Heck and Tingey, 1979


103.5 h/wk, 20 wk


4 h/d, 4 d/wk for 4 wk

continuous fumigation
continuous fumigation
continuous fumigation
continuous fumigation
continuous fumigation


Ashenden and
Mansfield, 1978
Taylor, in press
Taylor, in press

Thompson and Kats,
Thompson and Kats,
Thompson and Kats,
Thompson and Kats,
Thompson and Kats,







1978
1978
1978
1978
1978
                                                                                                                                                         oo
                                                                                                                                                         en
  5    Ammonia
                              Mustard
Injury
                                                                                   2.1 EOS
National Research

  Council, 1979b
                                                                                                                                                        o
                                                                                                                                                        •70
                                                                                                                                                        IN3

                                                                                                                                                        O

-------
Table B-l . (continued).

Representative
RAC chemical
6 Ethyl ene















7 Formaldehyde



8 Vinyl chloride

12 Benzene
13 Cyclohexene

14 Toluene
17 Aniline
22 Acrolein
23 Carbonyl sulfide






O
70
f—
Exposure 55
Test
organism3
African marigold


Carnation


Cotton


Lily family


Various plants



Alfalfa

Petunia

Cowpea, cotton,
squash
Pinto bean
Runner bean

Pinto bean
Loblolly pine
Alfalfa
Runner bean

Green bean
Duration
Response (hours)
Epinasty


Flowers do not open


Growth inhibition


Growth inhibition


Growth inhibition



Injury

Necrosis and leaf
symptoms
Injury

Red-bordered spots
LDKQ, toxicity
to leaves
Bronze color
Damage
Oxi dent-type damage
LD5Q, toxicity
to leaves
-13% growth
20


72


720


168


240



5

48

168

0.6
1

0.6
3
9
1

64
Concentration
(yg/m3)
1.15 EDO


1.15 E02


6.85 E02


8.60 E02


2.39 EOS



4.9 E02

2.47 E02

2.6 E05

3.0 E04
1.12 E12

1.88 E05
2.7 E02
2.5 E02
2.7 E03

4.9 E02
, ro
Notes0 Reference O
National Air
Pollution Control
Administration, 1970
National Air
Pollution Control
Administration, 1970
National Air
Pollution Control
Administration, 1970
National Air
Pollution Control
Administration, 1970
National Air
Pollution Control
Administration, 1970
00
National Research °^
Council, 1981
Kingsbury et al., 1979

Heck and Pires, 1962

Kingsbury et al . , 1979
Ivens, 1952

Kingsbury et al., 1979
Cheeseman and Perry, 1977
Kingsbury et al., 1979
Ivens, 1952

4 h/d, 4 d/w for 4 wk Taylor, in press

-------
Table B-l.   (continued).
Exposure
Representative
RAC chemical
32 Mercury (metal ic)




Mercuric chloride

Oimethylmercury

Test
organism3
Rose
Sugar beet
English ivy
Coleus, Thevetia
and Ricinus
Thevetia and
Ricinus
Coleus, Thevetia
and Ricinus

Response
Severe damage
Damage
Damage
Abscision

Necrosis

Abscision

Duration
(hours)

5
12
168

168

36

Concentration
(ug/m3) Notesb
1.0 E01
2.8 E02
1.5 E04
1.0 EOT

1.0 E01

1.0 E01


Reference
Stahl, 1969
Waldron and Terry,
Waldron and Terry,
Siegel and Siegel ,

Siegel and Siegel,

Siegel and Siegel,




1975
1975
1979

1979

1979

\atin binomials are listed in Appendix C.
DUnless "field" is noted, results are for laboratory studies.
cSee also Table 4.
                                                                                                                                                        00
                                                                                                                                                        10
                                                                                                                                                        ro
                                                                                                                                                        o

-------
Table B-2.  Toxicity of chemicals in soil  or solution  to vascular  plants.
RAC
9
11
13
14
15



16
19



20


21
22
Representative
chemical
Acetic acid
Methyl pyridine
Hexene
Xylene
Benzo( a)pyrene
3,4-benzopyrene
1 ,2-benzanthracene
1,2,5-6-di-
benzanthrancene
Dimethylalkylamine
Benzothiophene
Indole,
3-ethyl-lH
Indole-3
-acetic acid, 1H


Benzoic acid
2-hydroxy
-benzoic acid

Phenol
4-hydroxy
-benzaldehyde
Test organism*
and
life stage
Barley (seedling)
Alfalfa (sprout)
Oat (seedling)
Sugar beet (seedling)
Corn (sprout)
Tobacco (seedling)
Tobacco (seedling)
Tobacco (seedling)
Gram, rice
Cucumber (sprout)
Oat, cress,
mustard (sprout)
Oat, cress,
mustard (sprout)
Cucumber
Pea (sprout)
Lettuce (seedling)
Rice (seedling)
Lettuce (seedling)
Durum wheat (seed)
Lettuce (seedling)
Test medium
Solution in sand
Solution
Solution
Solution
Solution
Soil
Soil
Soil
Solution
Solution
Solution
Solution
Solution
Solution
Solution on
filter paper
Soil
Solution on
filter paper
Solution
Solution on
filter paper
Response Duration
Root growth inhibition 5d
Root growth inhibition 4d
Mortality
Root growth inhibition 2d
Root growth stimulation 6h
78% growth stimulation 60d
80% growth stimulation 60d
130% growth stimulation 60d
Mortality
9% root growth inhibition 4d
Growth inhibition
Growth inhibition
Mortality lid
Germination reduced by >50% 8h
23% growth inhibition
Seedling growth inhibition 5d
61% growth inhibition
Germination inhibition 4d
26% growth inhibition
Concentration
(ug/g)
600
93.1
25.2
100
0.0005
0.01
0.02
0.02
7.0
10
100
100
35
10
25
1.6
25
2000
100
Reference
Lynch, 1977
Naik et al.,1972
Chen and Elofson, 1978
Allen et al., 1961
Deubert et al., 1979
Graf and Nowak, 1966
Graf and Nowak, 1966
Graf and Nowak, 1966
Dutta et al., 1972
Schlesinger and Mowry, 1951
Oavies et al., 1937
Davies et al., 1937
Hilton and Nomura, 1964
Shukla, 1972
Chou and Patrick, 1976
Gaur and Pareek, 1976
Chou and Patrick, 1976
Badilescu et al., 1967
Chou and Patrick, 1976
^—
r—
—1
ro
O








00
oo









-------
Table B-2.  (continued).
Representative
RAC chemical
22 Acrolein
23 Carbon disulfide
24 Ethanol
27 N,N-dimethyl-
formamide
2-methyl
-benzamide
31 Arsenic*





32 Mercury

33 Nickel


Test organism*
and
life stage
Alfalfa
Apple
Lettuce (seed)
Lettuce (seed)
Poppy, chickweed,
carrot, ryegrass
corn, lucerne
(mature)
Corn
(seedling)
Cotton
(mature)
Cotton
(mature)
Soybean
(mature)
Soybean (mature)
Cowpea
Barley
(seed-sprout)
Barley
(seed-sprout)
Lettuce
(seed-sprout)
Corn
(mature)
Sunflower
(mature)

Test medium

Soil
Solution
Solution
Soil
Soil
Soil (fine sandy
loam)
Soil (clay)
Soil (fine sandy
loam)
Soil (clay)
-
Solution
Solution
Solution
Solution
Solution

Concentration
Response Duration (ug/g) Reference
Oxidant-type damage
Root injury
Germination inhibition
Nearly total suppression of
germination
13-87% reduction in yield
10% growth reduction
(wet tissue weight)
Approx. 55% reduction in yield
Approx. 40% reduction in yield
Approx. 45% reduction in yield
Approx. 40% reduction in yield
Retarded growth
12% growth reduction
(fresh weight)
12% growth reduction
(fresh weight)
68% reduction in elongation
of lettuce hypocotyl
10% decrease
in net photosynthesis
10% decrease
in net photosynthesis

9h 0.1
420
44h 1,000,000
24h 1,000,000
3-5w 220,000
4w 64
6w 8b
6w 28b
6w 3b
6w 12b
lb
7d post 5 (as Hg++)
germination
7d post 1 (as PMA)C
germination
5d post 109 (as
germination HgCl2)
7d 5
7d 0.8

Kingsbury et al., 1979
Underfill 1 and Cox, 1940
Meyer and Mayer, 1971
Meyer and Mayer, 1971
Pizey and Wain, 1959
Woolson, et al., 1971
Deuel and Swoboda, 1972
Deuel and Swoboda, 1972
Deuel and Swoboda, 1972
Oeuel and Swoboda, 1972
Albert and Arndt, 1932
Mukhiya et al., 1983
Mukhiya et al., 1983
Nag et al., 1980
Carlson et al., 1975
Carlson et al., 1975








O3
U3





0
70
•z.
J—
5
IO
ro
o

-------
Table B-2. (continued).
Test organism*
Representative and
RAC chemical life stage
33
Oats
(seeds-seedlings)
Oats (mature)
Barley
(seedling)
34 Cadmium Corn
(mature)
Sunflower
(mature)
Soybeans
(mature)
Bean (5 weeks old)
Beet (5 weeks old)
Turnip (5 weeks old)
Corn (5 weeks old)
Lettuce (5 weeks old)
Tomato (5 weeks old)
Barley (5 weeks old)
Pepper (5 weeks old)
Cabbage (5 weeks old)
Soybean
(seedling)
Wheat
(seedling)
Lettuce
(mature)

Test medium
Solution in
coarse sand
Soil
Solution in sand
Solution
Solution
Solution in sand
and vermiculite
Solution
Solution
Solution
Solution
Solution
Solution
Solution
Solution
Solution
Soil (silty clay
loam)
Soil (silty clay
loam)
Soil (silty clay
loam)

Response
Stunted growth
Decreased grain yield
Over 50% reduction in whole
plant fresh weight
10% decrease
in net photosynthesis
10% decrease
in net photosynthesis
35% decrease in fresh weight
of pods
50% growth reduction
50% growth reduction
50% growth reduction
50% growth reduction
50% growth reduction
50% growth reduction
50% growth reduction
50% growth reduction
50% growth reduction
15% reduction in yield
(dry weight)
20% reduction in yield
(dry weight)
40% reduction in yield
(fresh weight)

Duration
Up to
22d post
germination
Whole life
3w
7d
7d
90d
3w
3w
3w
3w
3w
3w
3w
3w
3w
5w
5w
Whole
life

Concentration
(u9/9)
10
50
281
(NiS04'7H20)
0.9
0.45
2
0.2
0.2
0.2
1.2
0.9
4.8
5.6
2.0
9.0
2.5
2.5
2.5

Reference
Vergnano and Hunter, 1953
Hal stead et al . , 1969
Agarwala et al ., 1977
Carlson et al., 1975
Carlson et al . , 1975
Huang et al . , 1974
Page et al . , 1972
Page et al., 1972
Page et al., 1972
Page et al., 1972
Page et al., 1972
Page et al., 1972
Page et al., 1972
Page et al., 1972
"Page et al., 1972
Haghiri, 1973
Haghiri, 1973
Haghiri, 1973
O
70
1—
10
no
O






O











-------
Table B-2.  (continued).
Test organism*
Representative and
RAC chemical life stage
34 Sycamore
(sapling)
3b Lead Soybeans
(mature)
Lettuce
(44d old)
Corn
(25d seedling)
Soybean
(25d seedling)
Sycamore
(sapling)
Test medium Response Duration
Soil (6:1 silty 25% reduction in new stem 90d
clay loam & perlite) growth
Solution in sand 35% decrease in fresh weight 90d
and vermiculite of pods
Soil (silty clay 25% reduction in yield 30d
loam)
Vermiculite and 20% decrease in ll-21d
solution photosynthesis
Vermiculite and 20% decrease in ll-21d
solution photosynthesis
Soil (6:1 silty 25% reduction in new stem 90d
clay loam & perlite) growth
Concentration
(ug/g) Reference
39
62
1000
(Pb(N03)2
1000
2000
500
Carlson and Bazzaz,
Huange et al ., 1974
1977

John and VanLaerhoven
1972
Bazzaz et al., 1974
Bazzaz et al., 1974
Carlson and Bazzaz,


1977
*Latin oinomials are listed in Appendix C.
aArsenic shows a stimulatory effect on plants when
 et al., 1971).
BConcentration of water extractable contaminant.
c(PMA-Phenyl mercuric acetate).
present at low concentrations  (40-50 pg/g total As or 5 ug/g extractable As in soil) (Woolson
                                                                                                                                                                   O
                                                                                                                                                                   73

-------


Table B-3. Toxicity of

Representative
RAC chemical
1 Carbon monoxide









2 Sulfur dioxide






Sulfuric acid





3 Nitrogen dioxide










4 Hydrogen sulfide



chemicals in air

Test
organism8
Rabbit

Dog

Chicken

Rabbit

Human

Guinea pig

Guinea pig
Dog

Chicken

Guinea pig

Guinea pig

Dog

Guinea pig

Rat

Rat

Mouse

Rat and mouse


Canaries, rats
and dogs


to animals.


Response
Aortic lesions

Heart damage

75% egg hatch

90% neonate survival

Lethality

Increased airway
resistance
LT50
Increased airway
resistance
Modified nasal
clearance
Respiratory function

Lethality

Respiratory function

LC50

11% lethality

Bronchial damage

Defects in pulmonary
microbial defense
Pulmonary pathologies


Pulmonary
irritation




Duration
(hours)
4

1008

432

720



1

1.1
5,400



1

8

4,725

1

5,120

24

24

Chronic





Exposure
Concentration
(ug/m3) Nates
1.51 £05

4.3 E04

4.9 E05 egg exposed

1.0 E05 mother exposed

9.2 EOS

4.2 E02

5.8 E06
1.3 E04

3.7 E03 Intermittent
exposure, 7 d
1.0 E02

1.8 E04

8.9 E02

1.5 £05

2.3 £04

2.8 E04

3.8 E03

9.4 E02 Also decreased
resistance to
infection
Subacute 7.0 E04 No established chronic

effects





Reference
National Research
Council, 1977a
National Research
Council, 1977a
National Research
Council, 1977a
National Research
Council, 1977a
Cleland and Kingsbury,
1977
U.S. EPA, 1982

U.S. EPA, 1982
U.S. EPA, 1982

Wakabayashi et a!.,
1977
Wakabayashi et al .,
1977
Wakabayashi et al. ,
1977
Wakabayashi et al. ,
1977
National Research
Council, 1977b
National Research
Council, 1977b
National Research
Council, 1977b
National Research
Council, 1977b
National Research
Council, 1977b

National Research
Council, 1979a
o
•yo
r—
—I
«3
PO
o















10
ro




















-------
Table B-3.  (continued).
Representative Test
RAC chemical organism3
5 Ammonia Chicken

Pig

Rabbit

Mouse

Human

6 Acetylene Human

7 Formaldehyde Rat

Guinea pigs

Rat


8 Chloroform Mouse
Human
9 Acetic acid Mouse
Human
Human

10 Furan Rat
Thiophene Mouse
11 Pyridine Rat
2-Ethylpyridine Rat
Exposure
Duration Concentration
Response (hours) (ug/m^) Notes Reference
Increased disease
susceptibility
Respiratory irritation

LJj-Q

Lethal threshold

Throat irritation

Unconsciousness

LC50

Increased airway
resistance
Respiratory and eye
irritation and
liver weight loss
LC50
Enlarged liver
LC50
Irritation
Respiratory, stomach
and skin irritation
Lethal threshold
Lethal threshold
LC50
LC100
72

840

33

16

Immediate

0.08

4

1

1400



Chronic
1
0.05
Chronic

8-48
8-48
4
3
1.3 E04

4.3 E04

7.0 E06

7.0 £05

2.8 E05

3.7 £08

5.7 £05

3.6 £02

1.0 £03


1.4 £05
4.9 £04
1.4 E07
2.0 £06
1.5 £05

2.4 £08
3.0 E07
1.3 £07
2.4 £07
Newcastle virus National Research
Council, 1979b
National Research
Council, 1979b
National Researcn
Council, 1979b
National Research
Council, 1979b
National Research
Council, 1979b
National Research
Council, 1976
National Researcn
Council, 1981
National Research
Council, 1981
National Research
Council, 1981

Kingsbury et al., 1979
In workplace air Kingsbury et al., 1979
Kingsbury et al . , 1979
Kingsbury et al., 1979
7-12 years, workplace National Research
exposure Council, 1976
Kingsbury et al., 1979
Kingsbury et al., 1979
Kingsbury et al . , 1979
Kingsbury et al., 1979












to
CO












0
^
r~
•*^
 12   Benzene
                           Human
                                              Lethal  threshold
                                                                      Chronic
1.9 £05     Workplace  exposure
                                                                                                                       National Research
                                                                                                                         Council, 1976
                                                                                                                                                        IN3
                                                                                                                                                        o

-------
Table B-3.  (continued).
RAC
13










14








15
16



17

18
19
20
Representative
chemical
Pentane
Cyclopentane
Hexane

Cyclohexane

Heptane
Butadiene

Cyclopentadine

Toluene

Ethyl benzene

p-Xylene
Tetrahydro-
napnthalene
Naphthalene

Test
organism3
Mouse
Mouse
Mouse
Human
Rabbit
Rabbit
Human
Human

Rat

Rat
Human
Rat
Human
Mouse

Guinea pig
Human

(No data on respiratory toxicity but
Ethyl ami ne


1 -Aminopropane
Aniline
Dimethyl anal ine
Rat
"Animals"

Rat
Rat
Mouse
Exposure
Duration Concentration
Response (hours) (ug/m3) Notes
Lethality
Lethality
Lethality
Dizziness
Lethality
Narcosis and convulsions
Dizziness
Respirtory and eye
irritation
Liver and kidney
damage
Lethal threshold
Psychological effects
Lethal threshold
Eye irritation
Lethal threshold

Lethal threshold
Eye irritation and
damage
several members of this RAC
Lethal threshold
Lung, liver and
kidney damage
50
50
LC50
..
—

0.
1
1
0.
8

245

4
--
4
<0.
4

136
--

are
4
1008

4
4
7
3
1
1
17 1
9
4
10 4
1

1

1
3
1
08 8
1

1
7

.8
.1
.2
.8
.2
.5
.1
.8

.4

.5
.8
.7
.8
.5

.5
.9

EOS
EOS
EOS
E07
E07
E07
E06
E07

E06 expsoure = 7 hr/day
for 35 days
E07
E05
E07
E05
E07

E06 8 hours for 17 days
E04

carcinogens)
5
1

5
9
7
.5
.8

.6
.5
.4
E06
E05

E06
E05
E05 Mixed isomers
Reference
Kingsbury
Kingsbury
Kingsbury
Kingsbury
Kingsbury
Kingsbury
Kingsbury
Kingsbury

Kingsbury

Kingsbury
Kingsbury
Kingsbury
Kingsbury
Kingsbury

Kingsbury
Kingsbury

Kingsbury
Kingsbury
Kingsbury

Kingsbury
Kingsbury
Kingsbury
et
et
et
et
et
et
et
et

et

et
et
et
et
et

et
et

et
et
et

et
et
et
al.,
al.,
al.,
al.,
al.,
al.,
al.,
al.,

al.,

al.,
al.,
al.,
al.,
al.,

al.,
al.,

al.,
al.,
al.,

al.,
al.,
al.,
1979
1979
1979
1979
1979
1979
1979
1979

1979

1979
1979
1979
1979
1979

1979
1979

1979
1979
1979

1979
1979
1979
(No data on respiratory toxicity)
(No data on respiratory toxicity)
(No data on respiratory toxicity)
                                                                                                                                                       1
                                                                                                                                                      to
                                                                                                                                                      ro
                                                                                                                                                      O
21   (No data on respiratory toxicity)

-------
Table B-3.  (continued).
Representative
RAC chemical
22 Acrolein



Acetal dehyde

Proprional dehyde



Butyral dehyde

Butanone

23 Methyl mercaptan
Ethyl mercaptan


n -Butyl mercaptan

Thiophenol
Carbon disulfide

24 Methanol

Exposure
Test
organism3
Rat

Monkey

Mice, rabbits and
guinea pigs
Rat

Rat

Rat

Mouse

Rat
Rat
Human

Rat
Human
Rat
Human

Monkey
Human
Response
LC50

Respiratory system
damage
LC50

LCcn

Reduced weight gain

50

50

Lethal threshold
l-Cso
Central nervous
system effects
'-''50
"Toxic effect"
Central nervous
system effects
LC5Q
Central nervous
Duration
(hours)
4

2,160

4

0.5

36

0.5

0.75

—
—
—

4
3
4



Concentration
(ug/m ) Notes
1.8 E04

5.1 E02

2.0 E06

6.2 E07

3.1 E06 6 h/d x 6 d

1.7 EOS

6.1 EOS

2.0 E07
1.1 E07
1.0 E04

1.5 E07
1.0 E04
1.5 E05
5.0 E04 7 years exposure

1.3 E06
7.5 E04
Reference
National Research
Council, 1981
National Research
Council, 1981
National Research
Council, 1981
National Research
Council, 1981
National Research
Council, 1981
National Research
Council, 1981
National Research
Council, 1981
Kingsbury et al . 1979
Kingsbury et al. 1979
Kingsbury et al . 1979

Kingsbury et al . 1979
Kingsbury et al . 1979
Kingsbury et al . 1979
Cleland and Kingsbury,
1977
Kingsbury et al . , 1979
Kingsbury et al., 1979
 25

 26
 27

 28
      Ethanol
                           Human
(No data on respiratory toxicity)

Methyl acetate       Human
Methyl methacrylate  Rat
Butyl acetate        Human
                     Human
n-Amyl acetate       Human
(No data on respiratory toxicity)

Acetonitrile

Acrylonitrile
Rat
Human
Rat
                                          system effects
                                        Eye and  respiratory                  1.9 E06
                                          irritation  and
                                          mental  effects
                   Severe  toxic effects       1         1.5 E06
                   LC50                       1         1.5 E07
                   Throat  irritation                    9.6 E05
                   Toxic effects              1         9.6 E06
                   Toxic threshold            0.5       1.0 E06
Lethal  threshold           4         1.3 E07
Bronchial  effects                    2.7 E05
Lethal  threshold           4         1.1 E06
                                                                                                                       Kingsbury et al., 1979
                                                                                            Kingsbury et al., 1979
                                                                                                                       Kingsbury et al.
                                                                                                                       Kingsbury et al.
                                                                                                                       Kingsbury et al.
                                                                                                                       Kingsbury et al.
                                                                                                                       Kingsbury et al.
                                                                                           1979
                                                                                           1979
                                                                                           1979
                                                                                           1979
                                                                                           1979
                                                                                                                                                        01
Kingsbury et al., 1979

Kingsbury et al., 1979
Kingsbury et al., 1979
Kingsbury et al., 1979
                                 O
                                 73
                                                                                                                             I
                                                                                                                             UD
                                                                                                                                                        ro
                                                                                                                                                        O

-------
Table B-3. (continued).
RAC
29
30
31
32
Representative
chemical
Test
organism3
Exposure
Duration Concentration
Response (hours) (yg/m^) Notes
(No data on respiratory toxicity)
Fly ash
Arsenic trioxide
Mercury (metal)
Monkey
Rat
Human
Rabbit
Human
Slight lung fibrosis 13,390 4.6 E02
Weight lag and 24 2.5 E01
physiological effects
Toxic threshold 1.0 E03
Toxic threshold 2.9 E04
Central nervous 1.7 E02 40 yr. exposure
system effects
ro
O
Reference
Kingsbury et al., 1979
National Research
Council, 1979c
National Research
Council, 1977c
Cassidy and Furr, 1978
Cassidy and Furr, 1978 10
Kingsbury et al . , 1979 ^
33   Nickel carbonyl
Rat
34   Cadmium oxide fumes  Human
     Cadmium oxide dust   Human
     Cadmium              Human
35   Lead
                          Human
0.5       2.4 E05
                   Lethality
                   Impaired lung function
                   Pulmonary and renal
                     effects

                   Threshold of overt
                     poisoning
          5.0 E03
          3.15 £03    20 yr.  exposure
          1.0-27 E01   Occupational  exposure
          5.0 E02     Occupational  exposure
National Research
  Council, 1975

Hammons et al., 1978
Hammons et al., 1978
Kingsbury et al., 1979
                                                                                                                      National Research
                                                                                                                        Council, 1972
 Latin binomials are lised in Appendix C.

-------
                         97                      ORNL/TM-9120
                   APPENDIX  C
Common and Scientific Names of Animals and Plants

-------
                            99
                     ORNL/TM-9120
                        Animals
Common name

Bigmouth buffalo
Black crappie
Bluegill
Brook trout
Brown trout
Canary
Carp
Channel catfish
Chicken
Chinook salmon
Coho salmon
Dog
Fathead minnow
Goldfish
Green sunfish
Guinea pig
Human
Largemouth bass
Monkey
Mosquitofish
Mouse
Northern pike
Pig
Pink salmon
Pumpkinseed
Rabbit
Rainbow trout
Rat
Smallmouth buffalo
White bass
Scientific name

Ictiobus cyprinellus
Pomoxis nigromaculatus
Lepomis macrochirus
Salvelinus fontinalis
Salmo tfutta
Serinus canarius
Cyprinus carpio
Ictalurus punctatus
Gallus gall us
Oncorhynchus tshawytacha
Oncorhynchus kisutch
Canis familiaris
Pimephales promelas
Carassius auratus
Lepomis cyanellus
Cavia cobaya
Homo sapiens
Micropterus salmoides
Macaca sp.
Gambusia affinis
Mus musculus
Esox lucius
Sus scrofa
Oncorhynchus gorbuscha
Lepomis gibbosus
Oryctolagus cuniculus
Salmo gairdneri
Rattus rattus
Ictiobus bulbalus
Morone chrysops

-------
ORNL/TM-9120
TOO
                            Plants
        Common name

        African marigold
        Alfalfa
        Apple
        Barley
        Bean
        Broadbean
        Bush bean
        Cabbage
        Carnation
        Carrot
        Chickweed,  common
        Cocksfoot
        Coleus
        Corn
        Cotton
        Cowpea
        Cress
        Cucumber
        Durum wheat
        Endive
        English ivy
        Gram
        Grapefruit
        Green bean
        Lettuce
        Loblolly pine
        Lucerne
        Meadowgrass
        Mustard
        Norway spruce
        Oat
        Oat, wild
        Pea
        Pepper
        Petunia
        Pinto bean
        Popinac
        Poppy
        Radish
        Red clover
        Rice
        Ricinus
        Rose
        Runner bean
        Ryegrass, Italina
        Soybean
        Spruce
        Squash
  Scientific name

  Tagetes sp.
  Medicago sativa
  Malus sylvestris
  Hordeum vulgare
  Phaseolus vulgaris
  Vicia faba
  Phaseolus vulgaris
  Brassica oleracea
  Dianthus caryophyllos
  Daucus carota
  Stellaria media
  Dactyl is glomerata
  Coleus blumei
  Zea mays
  Gossypium hirsutum
  Vigna sinensis
  Lepidium sativum
  Cucumis sativus
  Triticum durum
  Cicorium endivia
  Hedera helix
  Cicer arietinum
  Citrus paradisi
  Phaseolus vulgaris
  Lactuca sativa
  Pinus taeda
  Medicago sativa
  Poa pratensis
  Brassica alba
  Picea abies
  Avena sativa
  Psoralea corylifolia
  Capsicum frutescens
  Petunia sp.
  Phaseolus vulgaris
  Acacia farnesiana
  Papaver sp.
  Raphanus sativus
  Trifolium pratense
  Oryza sativa
  Ricinus communis
  Rosa sp.
  Phaseolus vulqaris
  Lolium mmtiflorurn
  Glycine max
  Picea abTes
  Cucurbita sp.

-------
                            101                     ORNL/TM-9120
Plants (continued)

Common name                   Scientific name

Sugar beet                    Beta vulgaris
Sunflower                     Helianthus annuus
Sycamore                      Platanus occidental is
Thevetia                      Thevetia neriifolca
Tobacco                       Nicotiana tabacum
Tomato                        Lycopersicon esculentum
Turnip                        Brassica napus
Wheat                         Triticum durum
White pine                    Pinus strobus

-------
                                103                     ORNL/TM-9120
                          APPENDIX D
Species-Specific Results of the Analysis of Extrapolation Error

-------
Table 0-1.  Predicted geometric mean maximum allowable  toxicant  concentrations  (PGMATCs) for each RAU and each species of fish.
PGMATC3 (mg/L)

1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
32A
33
34
35
RAU
Carbon monoxide
Sulfur oxides
Nitrogen oxides
Acid gases
Alkaline gases
Hydrocarbon gases 1,565
Formaldehyde
Volatile organochlorines
Volatile carboxylic acids
Volatile 0 & S heterocyclics
Volatile N heterocyclics
Benzene
Aliphatic/alicyclic hydrocarbons
Mono- or diaromatic hydrocarbons
Polycyclic aromatic hydrocarbons
Aliphatic amines
Aromatic amines
Alkaline N heterocyclics
Neutral N, 0, S heterocyclics
Carboxylic acids 48
Phenols
Aldehydes and ketones
Nonheterocylic organo S
Alcohols
Nitroaromatics
Esters
Amides
Nitriles
Tars
Respirable particles
Arsenic
Mercury (inorganic)
Mercury (methyl)
Nickel
Cadmium
Lead
Carp



8.8
43.5
,162
b
533
941
b
b
421
218
120
190
b
b
562
b
,548
462
12.7
b
b
b
33.0
B
215
t
b
238
34.2
11.7
94
11.1
54
Buffalo



8.8
43.5
1,565,162
b
1245
933
b
b
252
255
146
190
b
b
590
b
48,548
387
12.7
b
b
b
287.4
b
389
b
b
479
34.2
11.7
876
1.5
171
Channel
catfish



11.6
32.9
11,313
b
600
518
b
b
144
166
91
134
b
t
590
b
1435
207
11.7
b
b
b
160.9
b
237
b
b
247
26.9
10.9
410
2.0
104
White
bass



3.3
18.0
29,185
b
135
213
b
b
116
66
65
79
b
b
347
t
2001
182
4.9
b
t
ti
133.0
b
65
b
b
229
14.0
4.5
433
0.5
77
Green
sunf ish



6.7
18.0
29,185
b
705
213
b
b
116
66
65
121
b
b
141
b
2001
308
10.7
b
b
b
40.5
b
236
b
b
409
14.0
4.5
147
76.7
393
Bluegill
sunf ish



3.1
18.0
29,185
b
814
213
b
b
116
66
65
98
b
b
141
b
2001
302
5.4
b
b
b
26.6
b
220
b
b
424
14.0
4.5
124
57.0
404
Largemouth
bass



2.5
18.0
29,185
b
744
213
b
b
116
66
65
86
b
b
141
b
2001
271
8.1
b
b
b
22.8
b
196
b
b
383
14.0
4.5
110
51.3
364
Black
crappie



1.6
18.0
29,185
b
110
213
b
b
116
66
65
22
b
b
141
b
2001
52
2.4
b
b
b
8.1
b
41
b
b
67
14.0
4.5
26
14.8
65
Rainbow
trout



2.6
15.3
19,705
0
566
252
b
b
125
68
65
74
b
b
159
b
1317
208
4.0
b
b
b
145.9
D
160
b
b
257
11.9
2.3
552
0.2
61
Brook
trout



2.6
14.9
19,705
b
566
252
b
b
86
68
50
74
b
b
159
b
1317
131
4.4
b
b
b
97.6
b
160
b
D
281
12.0
4.4
296
0.3
102
                                                                                                                                                                 o
                                                                                                                                                                 en
                                                                                                                                                                o
                                                                                                                                                                •yo
                                                                                                                                                                ro
                                                                                                                                                                o

-------
ORNL/TM-9120
               106
Table D-2.  Probabilities of chronic toxic effects on fish populations
            due to RAC 4 at annual  median  ambient concentrations for
            the Lurgi/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
aBluegill - Perciformes
Probability of
exceeding the
    PGMATC
  Level of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
1.0017
1.0017
1.0017
0.7580
2.6564
1.3084
2.8465
3.4440
5.6337
0.5003
0.5003
0.5003
0.4529
0.6942
0.5578
0.7244
0.7399
0.7859
Class
Class
Class
Class
a
Genus
Species
Family
Family

-------
                                    107
                                       ORNL/TM-9120
Table D-3.  Probabilities of chronic toxic effects on fish populations
            due to RAC 5 at annual median ambient concentrations for
            the Lurgi/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
2.7565
2.7565
2.7565
3.6404
6.6493
6.6493
6.6493
6.6493
6.6493
0.6832
0.6832
0.6832
0.7149
0.8330
0.8330
0.8330
0.8330
0.8330
Class
Class
Class
Class
Class
Class
Class
Class
Class

-------
ORNL/TM-9120
               108
Table D-4.  Probabilities of chronic toxic effects on fish populations
            due to RAC 9 at annual  median ambient concentrations for
            the Lurgi/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
aFathead minnow - Cypriniformes
Probability of
exceeding the
    PGMATC
  Level of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.0756
0.0763
0.0763
0.1372
0.3336
0.3336
0.3336
0.3336
0.3336
0.0950
0.0943
0.0943
0.1730
0.3098
0.3098
0.3098
0.3098
0.3098
Family
a
a
Class
Class
Class
Class
Class
Class

-------
                                    109
                                       ORNL/TM-9120
Table D-5.  Probabilities of chronic toxic effects on fish populations
            due to RAC 31 at annual median ambient concentrations for
            the Lurgi/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
  to PGMATC
Probability of
exceeding the
   PGMATC
   Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.0326
0.0162
0.0162
0.0315
0.0340
0.0190
0.0184
0.0203
0.1161
0.0369
0.0282
0.0282
0.0662
0.0441
0.0181
0.0123
0.0227
0.1721
Family
Class
Class
Class
Class
Genus
Species
Family
Family

-------
ORNL/TM-9120
               110
Table D-6.  Probabilities of chronic toxic effects on fish populations
            due to RAC 32A at annual median ambient concentrations for
            the Lurgi/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.0072
0.0072
0.0072
0.0077
0.0187
0.0187
0.0187
0.0187
0.0187
0.0101
0.0101
0.0101
0.0162
0.0216
0.0216
0.0216
0.0216
0.0216
Class
Class
Class
Class
Class
Class
Class
Class
Class

-------
                                    Ill
                                       ORNL/TM-9120
Table D-7.  Probabilities of chronic toxic effects on fish populations
            due to RAC 33 at annual median ambient concentrations for
            the Lurgi/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.0099
0.0011
0.0011
0.0023
0.0022
0.0063
0.0075
0.0085
0.0355
0.0073
0.0008
0.0008
0.0042
0.0010
0.0033
0.0027
0.0066
0.0670
Family
Class
Class
Class
Class
Genus
Species
Family
Family

-------
ORNL/TM-9120
               112
Table D-8.  Probabilities of chronic toxic effects on fish populations
            due to RAC 34 at annual  median ambient concentrations for
            the Lurgi/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.0076
0.0551
0.0551
0.0427
0.1617
0.0011
0.0015
0.0017
0.0057
0.0026
0.0884
0.0884
0.0845
0.1816
0.0001
0.0001
0.0004
0.0097
Species
Class
Class
Class
Class
Genus
Species
Family
Family

-------
                                    113
                                       ORNL/TM-9120
Table D-9.  Probabilities of chronic toxic effects on fish populations
            due to RAC 35 at annual median ambient concentrations for
            the Lurgi/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.0183
0.0057
0.0057
0.0094
0.0123
0.0025
0.0024
0.0027
0.0152
0.0168
0.0080
0.0080
0.0207
0.0134
0.0008
0.0004
0.0012
0.0329
Family
Class
Class
Class
Class
Genus
Species
Family
Family

-------
ORNL/TM-9120
               114
Table D-10.  Probabilities of chronic toxic effects on fish populations
             due to RAC 4 at annual median ambient concentrations for
             the Koppers-Totzek/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
aBluegi11-Perciformes
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.8924
0.8924
0.8924
0.6753
2.3665
1.1657
2.5357
3.0682
5.0189
0.4796
0.4796
0.4796
0.4334
0.6728
0.5330
0.7020
0.7201
0.7701
Class
Class
Class
Class
a
Genus
Species
Family
Family

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                                    115
                                               ORNL/TM-9120
Table D-ll.
Probabilities of chronic toxic effects on fish populations
due to RAC 5 at annual median ambient concentrations for
the Koppers-Totzek/Fischer-Tropsch process
Species
        Ratio of ambient
        concentration to
           to PGMATC
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.8527
0.8527
0.8527
1.1262
2.0569
2.0569
2.0569
2.0569
2.0569
0.4701
0.4701
0.4701
0.5208
0.6435
0.6435
0.6435
0.6435
0.6435
Class
Class
Class
Class
Class
Class
Class
Class
Class

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ORNL/TM-9120
               116
Table D-12.  Probabilities of chronic toxic effects on fish populations
             due to RAC 9 at annual median ambient concentrations for
             the Koppers-Totzek/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
aFathead minnow - Cypriniformes
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.6911
0.6972
0.6972
1.2547
3.0498
3.0498
3.0498
3.0498
3.0498
0.4256
0.4269
0.4269
0.5429
0.6930
0.6930
0.6930
0.6930
0.6930
Family
a
a
Class
Class
Class
Class
Class
Class

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                                    117
                                               ORNL/TM-9120
Table D-13.
Probabilities of chronic toxic effects on fish populations
due to RAC 31 at annual median ambient concentrations for
the Koppers-Totzek/Fischer-Tropsch process
Species
        Ratio of ambient
        concentration to
           to P6MATC
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.0113
0.0056
0.0056
0.0109
0.0118
0.0066
0.0064
0.0071
0.0403
0.0096
0.0082
0.0082
0.0247
0.0126
0.0040
0.0022
0.0055
0.0792
Family
Class
Class
Class
Class
Genus
Species
Family
Family

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ORNL/TM-9120
               118
Table D-14.  Probabilities of chronic toxic effects on fish populations
             due to RAC 33 at annual  median ambient concentrations for
             the Koppers-Totzek/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.0048
0.0005
0.0005
0.0011
0.0010
0.0031
0.0036
0.0041
0.0173
0.0024
0.0003
0.0003
0.0016
0.0003
0.0010
0.0007
0.0022
0.0343
Family
Class
Class
Class
Class
Genus
Species
Family
Family

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                                    119
                                       ORNL/TM-9120
Table D-15.  Probabilities of chronic toxic effects on fish populations
             due to RAC 34 at annual median ambient concentrations for
             the Koppers-Totzek/Fischer-Tropsch process
Species
Ratio of ambient
concentration to
   to PGMATC
Probability of
exceeding the
    PGMATC
  Level  of
extrapolation
Carp
Bigmouth buffalo
Smallmouth buffalo
Channel catfish
White bass
Green sunfish
Bluegill sunfish
Largemouth bass
Black crappie
0.0047
0.0339
0.0339
0.0262
0.0993
0.0007
0.0009
0.0010
0.0035
0.0011
0.0573
0.0573
0.0562
0.1246
0.0000
0.0000
0.0002
0.0052
Species
Class
Class
Class
Class
Genus
Species
Family
Family

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                   121                     ORNL/TM-9120
             APPENDIX  E

Detailed Methods and Assumptions for
    Ecosystem Uncertainty Analysis

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                                    123                     ORNL/TM-9120

                               APPENDIX  E

                  DETAILED  METHODS  AND ASSUMPTIONS FOR
                     ECOSYSTEM UNCERTAINTY  ANALYSIS

E.I  ORGANIZING TOXICITY DATA
     The first step  in Ecosystem Uncertainty Analysis (EUA) is selection
of appropriate toxicity data and association of the data with components
of SWACOM.
     Toxicity data on phytoplankton are sparse.  It is possible to find
values for green algae, such as Selenastrum capricornutum. and these
data are used for all 10 algal populations if no other information is
available.  If data  are available on diatoms and blue-greens, then a
further division is  possible based on physiological parameters in the
model and past experience with SWACOM.  Like diatoms, species 1-3 appear
early in the spring  and are associated with low temperatures and high
nutrient concentrations.  Species 4 to 7 dominate the spring bloom and
are associated with  intermediate temperatures and light.  Species 8 to
10 appear in the summer and are tolerant of high temperatures and low
nutrient concentrations.
     The identification of the zooplankton is more tenuous.  Based on
model behavior and physiological parameters, species 12 and 13 are
identified with Cladocerans.  The ubiquitous data for Daphnia magna are
used for species 12.  When data are available for Daphnia pulex, they
are used for species 13.  The remaining zooplankters (species 11, 14
and 15, and species  13 when no data was available for £. pulex) are
simply identified as crustaceans.  Of the available data, the smallest
concentration is assigned to 15 and the largest to 11.  Species 14 (and
13 when necessary) is assigned an intermediate value between these
extremes.  Assuming  species 15 to be the most sensitive is conservative.
Since blue-green algae increase is one of our endpoints, we assign the
greatest sensitivity to the consumer (i.e., 15) which is most abundant
during the summer of the simulated year.

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ORNL/TM-9120                        124

     LC50 data for fathead minnow (Pimephales sp.), bluegill (Lepomis
macrochirus), and guppy (Poecilia reticulata) are assigned to forage
fish (species 16, 17 and 18).  When data on these species are not
available, others are substituted, such as goldfish or mosquitofish.
The game fish (species 19) was identified as rainbow trout.

E.2  TRANSFORMING TOXICITY DATA
     A critical step in applying EUA involves changing parameter values
in SWACOM.  This requires three important assumptions which are
outlined below.

E.2.1  The General Stress Syndrome (GSS)
     Toxicity tests provide information on mortality (or similar
endpoint) but provide little insight on the mode of action of the
chemicals.  Thus, some assumption must be made about how the toxicant
affects physiological processes in SWACOM.  In an application that
focuses on a single chemical it may be possible to obtain detailed
information on modes of action.  However, the present effort must cover
a number of Risk Assessment Units, and it was necessary to make a
single overall assumption.
     We assumed that organisms respond to all toxicants according to a
General Stress Syndrome (GSS).  For phytoplankton, this involved
decreased maximum photosynthetic rate, increased Michaelis-Menten
constant, increased susceptibility to grazing, decreased light
saturation, and decreased nutrient assimilation.  For zooplankton and
fish, the syndrome involves increased respiration, decreased grazing
rates, increased susceptibility to predation, and decreased nutrient
assimilation.  For all organisms, the optimum temperature was assumed
to be unchanged.  The GSS represents how organisms respond to most
toxicants.  Where observations were recorded for the chemicals used in
this assessment, the researchers noted hyperactivity, increased
operculation and other symptoms consistent with the assumption of the
GSS.  However, some organics might have a "narcotic" effect which would
be opposite to the reaction assumed here.

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                                    125                     ORNL/TM-9120

     The General Stress Syndrome defines the direction of change of
each parameter  in SWACOM.  It is also necessary to make an assumption
about the relative change in each parameter.  We have assumed that all
parameters of SWACOM change by the same percentage.  This assumption
can be removed  only if considerable information is available on modes
of action of each chemical.

E.2.2  The MICROCOSM Simulations
     The key to arriving at new parameters is simulation of the
experiments which generated the toxicity data.  This involves simulating
each species in isolation with light, temperature, food supply, and
nutrients set at constant levels that would maintain the population
indefinitely.   Then the parameters are altered together in the direction
indicated by the 6SS until we duplicate the original experiment.  Thus,
for an LC^0 (96 hours), we find the percentage change which halves
the population  in 4 d.
     At the conclusion of the MICROCOSM simulations, we have the
percentage change in the parameters which matches the experiment.
We must now make an additional assumption to arrive at the expected
response for concentrations below the LC™ or EC     We assume a
linear dose response.  Thus, an environmental concentration 1/5 of the
LC5Q would cause a 10% reduction in the population.  The MICROCOSM
simulations are then repeated with this new endpoint to arrive at a new
percentage change in the parameters.  Since most response curves are
concave, our assumption should be conservative.

E.2.3  Choosing Uncertainties
     To implement the analysis, it is necessary to associate
uncertainties with the parameter changes.  We assume that all parameter
changes have an associated uncertainty of plus or minus 100%.  This
assumption seems sufficiently conservative.  One might wish to adopt a
more complex strategy which would combine information on modes of
action with a Delphi survey of experienced researchers to arrive at
more specific estimates of uncertainty.

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                                     127


                                                            ORNL/TM-9120

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ORNL/TM-9120                        128
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                                129                     ORNL/TM-9120
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    ORNL/TM-9120                         130
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