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382User Guide for Thresholds and ClassificationsEC 2003. Technical Guidance Document in Support of Commission Directive 93/96/EEC on RiskAssessment for New Notified Substances and Commission Regulation (EC) No. 1488/94 on RiskAssessment for Existing Substances. European Commission, Brussels. http://ecb.jrc.it/tgdECETOC 1995. The Role of Bioaccumulation in Environmental Risk Assessment: The Aquatic Environmentand Related Food Webs. European Centre for Ecotoxicology and Toxicology of Chemicals, Brussels.Ghose, AK, Prottchet, A, Crippen, GM 1988. Journal of Computational Chemistry 9: 80–90.Gobas, FAPC, Clark, KE, Shiu, WY, Mackay, D 1989. Bioconcentration of polybrominated benzenes andbiphenyls and related superhydrophobic chemicals in fish: role of bioavailability and elimination into feces.Environmental Toxicology and Chemistry 8: 231–245.Gobas, FAPC, Opperhuizen, A, Hutzinger, O 1986. Bioconcentration of hydrophobic chemicals in fish:relationship with membrane permeation. Environmental Toxicology and Chemistry 5: 637–646.Hansch, C, Leo, A 1979. Substituent Constants for Correlation Analysis in Chemistry and Biology. Wiley,New York, NY.Henderson, RJ, Tocher, DR 1987. The lipid composition and biochemistry of freshwater fish. Progress inLipid Research 26: 281–347.Howard, PH, Meylan, WM 1997. Prediction of physical properties, transport, and degradation forenvironmental fate and exposure assessments. In: Chen, F, and Schüürmann, G (eds) QuantitativeStructure-Activity Relationships in Environmental Sciences VII, Proceedings QSAR96. SETAC Press,Pensacola, FL, pp 185–205.Klopman, G, Li, JY, Wang, S, Dimayuga, M 1994. Computer automated log P calculations based on anextended group contribution approach. Journal of Chemical Information and Computer Sciences 34: 752–781.McCarthy, JF, Jimenez, BD 1985. Reduction in bioavailability to bluegills of polycyclic aromatic hydrocarbonsbound to dissolved humic material. Environmental Toxicology and Chemistry 4: 511–521.McKim, JM, Goeden, HM 1982. A direct measure of the uptake efficiency of a xenobiotic chemical across thegill of brook trout (Salvelinus fontinalis) under normoxic and hypoxic conditions. Computational Biochemistryand Physiology 72C: 65–74.Meylan, WM, Howard, PH 1995. Atom/fragment contribution methods for estimating octanol-water partitioncoefficients. Journal of Pharmacological Science 84: 83.Niemelä, JR 1993. QTOXIN-program (ver 2.0). Danish Environmental Protection Agency.Niemi, GJ, Basak, SC, Veith, GD, Grunwald, G 1992. Prediction of octanol/water partition coefficient (Kow)with algorithmically derived variables. Environmental Toxicology and Chemistry 11: 893–900.Nieimi, AJ 1991. Solubility of organic chemicals in octanol, triolin and cod liver oil and relationships betweensolubility and partition coefficients. Water Research 25: 1515–1521.January 2012 EPA0109
383User Guide for Thresholds and ClassificationsOECD 1993. Application of Structure Activity Relationships to the Estimation of Properties Important inExposure Assessment, Environment Monograph No. 67. Environment Directorate, Organisation forEconomic Co-operation and Development, Paris. http://www.olis.oecd.org/olis/1993doc.nsf/LinkTo/ocdegd(93)125OECD 2006. OECD Guidelines for the Testing of Chemicals Test No. 123: Partition Coefficient (1-Octanol/Water): Slow-Stirring Method. Organisation for Economic Co-operation and Development, Paris.http://fiordiliji.sourceoecd.org/vl=13139817/cl=18/nw=1/rpsv/ij/oecdjournals/1607310x/v1n1/s22/p1Opperhuizen, A 1986. Bioconcentration of hydrophobic chemicals in fish. In: Poston, TM, Purdy, R (eds)Aquatic Toxicology and Environmental Fate, 9th volume, ASTM STP 921. American Society for Testing andMaterials, Philadelphia, PA.Opperhuizen, A, Van der Velde, EW, Gobas, FAPC, Liem, AKD, Van der Steen, JMD, Hutzinger, O 1985.Relationship between bioconcentration in fish and steric factors of hydrophobic chemicals. Chemosphere 14:1871–1896.Opperhuizen, A, Schrap, SM 1987. Relationship between aqueous oxygen concentration and uptake andelimination rates during bioconcentration of hydrophobic chemicals in fish. Environmental Toxicology andChemistry 6: 335–342.Opperhuizen, A, Sijm, DTHM 1990. Bioaccumulation and biotransformation of polychlorinated dibenzo-pdioxinsand dibenzofurans in fish. Environmental Toxicology and Chemistry 9: 175–186.Pedersen, F, Tyle, H, Niemelä, JR, Guttmann, B, Lander, L, Wedebrand, A, 1995. Environmental HazardClassification: Data Collection and Interpretation Guide for Substances to be Evaluated for Classification asDangerous for the Environment, 2nd edition. Nordic Council of Ministers, TemaNord 1995:581.Petersen, GI, Kristensen, P 1998. Bioaccumulation of lipophilic substances in fish early life stages.Environmental Toxicology and Chemistry 17: 1385–1395.Rekker, RF, de Kort, HM 1979. The hydrophobic fragmental constant: an extension to a 1000 data point set.European Journal of Medicinal Chemistry 14: 479–488.Roberts, DW 1989. Aquatic toxicity of linear alkyl benzene sulphonates (LAS): a QSAR analysis.Communicaciones Presentadas a las Jornadas del Comite Espanol de la Detergencia 20: 35–43. (Also inTurner, JE, England, MW, Schultz, TW, Kwaak, NJ (eds) QSAR 88: Proceedings of the Third InternationalWorkshop on Qualitative Structure-Activity Relationships in Environmental Toxicology, 22–26 May 1988,Knoxville, Tennessee, pp 91–98.)Schrap, SM, Opperhuizen, A 1990. Relationship between bioavailability and hydrophobicity: reduction of theuptake of organic chemicals by fish due to the sorption of particles. Environmental Toxicology and Chemistry9: 715–724.Shiu, WY, Doucette, W, Gobas, FAPC, Andren, A, Mackay, D 1988. Physical-chemical properties ofchlorinated dibenzo-p-dioxins. Environmental Science and Technology 22: 651–658.January 2012 EPA0109
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