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Volumn 45, Issue 12, 2010, Pages 1550-1594

Dow and Kaw,eff vs. Kow and K aw: Acid/base ionization effects on partitioning properties and screening commercial chemicals for long-range transport and bioaccumulation potential

Author keywords

Bioaccumulation potential; Chemical screening; Ionizable compounds; Long range transport potential; Partitioning property estimation

Indexed keywords

BIOACCUMULATION POTENTIAL; CHEMICAL SCREENING; IONIZABLE COMPOUNDS; LONG RANGE TRANSPORT; PROPERTY ESTIMATION;

EID: 79952032580     PISSN: 10934529     EISSN: 15324117     Source Type: Journal    
DOI: 10.1080/10934529.2010.506114     Document Type: Article
Times cited : (20)

References (26)
  • 1
    • 33845326143 scopus 로고    scopus 로고
    • Are there other persistent organic pollutants? A challenge for environmental chemists
    • DOI 10.1021/es061677a
    • Muir, D.C.G.; Howard, P.H. Are there other persistent organic pollutants? Achallenge for environmental chemists. Environ. Sci. Technol. 2006, 40, 7157-7166. (Pubitemid 44871822)
    • (2006) Environmental Science and Technology , vol.40 , Issue.23 , pp. 7157-7166
    • Muir, D.C.G.1    Howard, P.H.2
  • 2
    • 77950415995 scopus 로고    scopus 로고
    • Identifying new persistent and bioaccumulative organics among chemicals in commerce
    • Howard, P.H.; Muir, D.C.G. Identifying new persistent and bioaccumulative organics among chemicals in commerce. Environ. Sci. Technol. 2010, 44, 2277-2285.
    • (2010) Environ. Sci. Technol. , Issue.44 , pp. 2277-2285
    • Howard, P.H.1    Muir, D.C.G.2
  • 3
    • 0033037957 scopus 로고    scopus 로고
    • Improved method for estimating bioconcentration/bioaccumulation factor from octanol/water partition coefficient
    • Meylan, W.M.; Howard, P.H.; Boethling, R.S.; Aronson, D.; Printup, H.; Gouchie, S. Improved method for estimating bioconcentration/bioaccumulation factor from octanol/water partition coefficient. Environ. Toxicol. Chem. 1999, 18, 664-672.
    • (1999) Environ. Toxicol. Chem. , vol.18 , pp. 664-672
    • Meylan, W.M.1    Howard, P.H.2    Boethling, R.S.3    Aronson, D.4    Printup, H.5    Gouchie, S.6
  • 4
    • 0037394203 scopus 로고    scopus 로고
    • Assessing the potential of persistent organic chemicals for long-range transport and accumulation in polar regions
    • DOI 10.1021/es026019e
    • Wania, F.Assessing the potential of persistent organic chemicals for long-range transport and accumulation in polar regions. Environ. Sci. Technol. 2003, 37, 1344-1351. (Pubitemid 36504950)
    • (2003) Environmental Science and Technology , vol.37 , Issue.7 , pp. 1344-1351
    • Wania, F.1
  • 6
    • 31144432913 scopus 로고    scopus 로고
    • Potential of degradable organic chemicals for absolute and relative enrichment in the Arctic
    • DOI 10.1021/es051406k
    • Wania, F. Potential of degradable organic chemicals for absolute and relative enrichment in the Arctic. Environ. Sci. Technol. 2006, 40, 569-577. (Pubitemid 43134025)
    • (2006) Environmental Science and Technology , vol.40 , Issue.2 , pp. 569-577
    • Wania, F.1
  • 7
    • 1842782842 scopus 로고    scopus 로고
    • Bioaccumulation Potential of Persistent Organic Chemicals in Humans
    • DOI 10.1021/es034871v
    • Czub,G.;McLachlan,M.S. Bioaccumulation potential of persistent organic chemicals in humans. Environ. Sci. Technol. 2004, 38, 2406-2412. (Pubitemid 38481046)
    • (2004) Environmental Science and Technology , vol.38 , Issue.8 , pp. 2406-2412
    • Czub, G.1    McLachlan, M.S.2
  • 8
    • 34447503810 scopus 로고    scopus 로고
    • Food web-specific biomagnification of persistent organic pollutants
    • DOI 10.1126/science.1138275
    • Kelly, B.C.; Ikonomou, M.G.; Blair, J.D.; Morin, A.E.; Gobas, F.A.P.C. Food web-specific biomagnification of persistent organic pollutants. Science 2007, 317, 236-239. (Pubitemid 47076197)
    • (2007) Science , vol.317 , Issue.5835 , pp. 236-239
    • Kelly, B.C.1    Ikonomou, M.G.2    Blair, J.D.3    Morin, A.E.4    Gobas, F.A.P.C.5
  • 9
    • 48249087617 scopus 로고    scopus 로고
    • Screening chemicals for the potential to be persistent organic pollutants: A case study of Arctic contaminants
    • Brown, T.N.; Wania, F. Screening chemicals for the potential to be persistent organic pollutants: A case study of Arctic contaminants. Environ. Sci. Technol. 2008, 42, 5202-5209.
    • (2008) Environ. Sci. Technol. , vol.42 , pp. 5202-5209
    • Brown, T.N.1    Wania, F.2
  • 10
    • 43749122851 scopus 로고    scopus 로고
    • Combining long-range transport and bioaccumulation considerations to identify potential arctic contaminants
    • DOI 10.1021/es7028679
    • Czub, G.; Wania, F.; McLachlan, M.S. Combining long range transport and bioaccumulation considerations to identify potential Arctic contaminants. Environ. Sci. Technol. 2008, 42, 3704-3709. (Pubitemid 351694081)
    • (2008) Environmental Science and Technology , vol.42 , Issue.10 , pp. 3704-3709
    • Czub, G.1    Wania, F.2    Mclachlan, M.S.3
  • 11
    • 77953621324 scopus 로고    scopus 로고
    • Assessment of chemical screening outcomes based on different partitioning property estimation methods
    • doi:10.1016/j.envint.2010.03.010
    • Zhang, X.; Brown, T.N.; Wania, F.; Heimstad, E.S.; Goss, K.U. Assessment of chemical screening outcomes based on different partitioning property estimation methods. Environ. Int. 2010, doi:10.1016/j.envint.2010.03.010.
    • (2010) Environ. Int.
    • Zhang, X.1    Brown, T.N.2    Wania, F.3    Heimstad, E.S.4    Goss, K.U.5
  • 12
    • 46849118468 scopus 로고    scopus 로고
    • Policies for chemical hazard and risk priority setting: Can persistence, bioaccumulation, toxicity, and quantity information be combined?
    • DOI 10.1021/es800106g
    • Arnot, J.A.; Mackay,D. Policies for chemical hazard and risk priority setting: Can persistence, bioaccumulation, toxicity, and quantity information be combined?. Environ. Sci. Technol. 2008, 42, 4648-4654. (Pubitemid 351956392)
    • (2008) Environmental Science and Technology , vol.42 , Issue.13 , pp. 4648-4654
    • Arnot, J.A.1    Mackay, D.2
  • 13
    • 0023965741 scopus 로고
    • Smiles, a chemical language and information system. 1. Introduction to methodology and encoding rules
    • Weininger, D. SMILES: A chemical language and information system. 1. Introduction to methodology and encoding rules. J. Chem. Inf. Comp. Sci. 1988, 28, 31-36. (Pubitemid 18574254)
    • (1988) Journal of Chemical Information and Computer Sciences , vol.28 , Issue.1 , pp. 31-36
    • Weininger David1
  • 15
    • 77955009477 scopus 로고    scopus 로고
    • Performance of the ALOGPS 2.1 program for octanol-water partition coefficient prediction with organic chemicals on the Canadian Domestic Substances List
    • doi: 10.1038/npre.2009.3882.1
    • Rayne, S.; Forest, K. Performance of the ALOGPS 2.1 program for octanol-water partition coefficient prediction with organic chemicals on the Canadian Domestic Substances List. Nat. Prec. 2009, doi: 10.1038/npre.2009.3882. 1.
    • (2009) Nat. Prec.
    • Rayne, S.1    Forest, K.2
  • 16
    • 9744242745 scopus 로고    scopus 로고
    • Prediction of the solubility, activity coefficient and liquid/liquid partition coefficient of organic compounds
    • DOI 10.1002/qsar.200430866
    • Hilal, S.H.; Carreira, L.A.; Karickhoff, S.W. Prediction of the solubility, activity coefficient, gas/liquid and liquid/liquid distribution coefficients of organic compounds. QSAR Comb. Sci. 2004, 23, 709-720. (Pubitemid 39582806)
    • (2004) QSAR and Combinatorial Science , vol.23 , Issue.9 , pp. 709-720
    • Hilal, S.H.1    Karickhoff, S.W.2    Carreira, L.A.3
  • 17
    • 0028889384 scopus 로고
    • A rigorous test for SPARC's chemical reactivity models: Estimation of more than 4300 ionization pKas
    • Hilal, S.H.; Karickhoff, S.W.; Carreira, L.A. A rigorous test for SPARC's chemical reactivity models: Estimation of more than 4300 ionization pKas. Quant. Struc.-Act. Relat. 1995, 14, 348-355.
    • (1995) Quant. Struc.-Act. Relat. , vol.14 , pp. 348-355
    • Hilal, S.H.1    Karickhoff, S.W.2    Carreira, L.A.3
  • 18
    • 37749028133 scopus 로고    scopus 로고
    • Calculating physical properties of organic compounds for environmental modeling from molecular structure
    • Hilal, S.H.; Saravanaraj, A.N.;Whiteside, T.; Carreira, L.A. Calculating physical properties of organic compounds for environmental modeling from molecular structure. J. Comput. Aided Mol. Des. 2007, 21, 693-708.
    • (2007) J. Comput. Aided Mol. Des. , vol.21 , pp. 693-708
    • Hilal, S.H.1    Saravanaraj, A.N.2    Whiteside, T.3    Carreira, L.A.4
  • 20
    • 33845324906 scopus 로고    scopus 로고
    • Predicting the partitioning behavior of various highly fluorinated compounds
    • DOI 10.1021/es060744y
    • Arp, H.P.H.; Niederer, C.; Goss, K.U. Predicting the partitioning behavior of various highly fluorinated compounds. Environ. Sci. Technol. 2006, 40, 7298-7304. (Pubitemid 44871840)
    • (2006) Environmental Science and Technology , vol.40 , Issue.23 , pp. 7298-7304
    • Arp, H.P.H.1    Niederer, C.2    Goss, K.-U.3
  • 21
    • 68049140905 scopus 로고    scopus 로고
    • Comment on "Perfluoroalkyl contaminants in an Arctic marine food web: Trophic magnification and wildlife exposure."
    • Rayne, S.; Forest, K. Comment on "Perfluoroalkyl contaminants in an Arctic marine food web: Trophic magnification and wildlife exposure." Environ. Sci. Technol. 2009, 43, 6112-6112.
    • (2009) Environ. Sci. Technol. , vol.43 , pp. 6112-6112
    • Rayne, S.1    Forest, K.2
  • 22
    • 70449625571 scopus 로고    scopus 로고
    • Perfluoroalkyl sulfonic and carboxylic acids: A critical review of physicochemical properties, levels and patterns in waters and waste waters, and treatment methods
    • Rayne, S.; Forest, K. Perfluoroalkyl sulfonic and carboxylic acids: A critical review of physicochemical properties, levels and patterns in waters and waste waters, and treatment methods. J. Environ. Sci. Health, Pt. A 2009, 44, 1145-1199.
    • (2009) J. Environ. Sci. Health, Pt. A , vol.44 , pp. 1145-1199
    • Rayne, S.1    Forest, K.2
  • 24
    • 80053201026 scopus 로고    scopus 로고
    • Re-evaluating the list of high-production chemicals predicted to become Arctic contaminants
    • doi:10.1038/npre.2010.4436.1
    • Rayne, S.;Forest, K.Re-evaluating the list of high-production chemicals predicted to become Arctic contaminants. Nat. Prec. 2010, doi:10.1038/npre.2010. 4436.1.
    • Nat. Pre , vol.2010
    • Rayne, S.1    Forest, K.2
  • 25
    • 0028976130 scopus 로고
    • A global distribution model for persistent organic chemicals
    • Wania, F.; Mackay, D. A global distribution model for persistent organic chemicals. Sci. Total Environ. 1995, 161, 211-232.
    • (1995) Sci. Total Environ. , vol.161 , pp. 211-232
    • Wania, F.1    Mackay, D.2
  • 26
    • 0031925001 scopus 로고    scopus 로고
    • Dietary accumulation and depuration of hydrophobic organochlorines: Bioaccumulation parameters and their relationship with the octanol/water partition coefficient
    • DOI 10.1897/1551-5028(1998)017<0951:DAADOH>2.3.CO;2
    • Fisk, A.T.; Norstrom, R.J.; Cymbalisty, C.D.; Muir, D.C.G. Dietary accumulation and depuration of hydrophobic organochlorines: Bioaccumulation parameters and their relationship with the octanol/water partition coefficient. Environ. Toxicol. Chem. 1998, 17, 951-961. (Pubitemid 28185959)
    • (1998) Environmental Toxicology and Chemistry , vol.17 , Issue.5 , pp. 951-961
    • Fisk, A.T.1    Norstrom, R.J.2    Cymbalisty, C.D.3    Muir, D.G.G.4


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.