메뉴 건너뛰기




Volumn 42, Issue 14, 2008, Pages 5189-5195

How do the partitioning properties of polyhalogenated POPs change when chlorine is replaced with bromine?

Author keywords

[No Author keywords available]

Indexed keywords

ALCOHOLS; BROMINE; CHLORINE;

EID: 48249109059     PISSN: 0013936X     EISSN: None     Source Type: Journal    
DOI: 10.1021/es8002348     Document Type: Article
Times cited : (42)

References (39)
  • 1
    • 34548846434 scopus 로고    scopus 로고
    • Polybrominated diphenyl ethers (PBDEs) in marine sediments from industrialized bays of Korea
    • Moon, H. B.; Kannan, K.; Choi, M.; Choi, H. G. Polybrominated diphenyl ethers (PBDEs) in marine sediments from industrialized bays of Korea. Mar. Pollut. Bull. 2007, 54, 1402-1412.
    • (2007) Mar. Pollut. Bull , vol.54 , pp. 1402-1412
    • Moon, H.B.1    Kannan, K.2    Choi, M.3    Choi, H.G.4
  • 2
  • 4
    • 33847185544 scopus 로고    scopus 로고
    • Characterizing the emissions of polybrominated dibenzo-p-dioxins and dibenzofurans from municipal and industrial waste incinerators
    • Wang, L. C.; Chang-Chien, G. P. Characterizing the emissions of polybrominated dibenzo-p-dioxins and dibenzofurans from municipal and industrial waste incinerators. Environ. Sci. Technol. 2007, 41, 1159-1165.
    • (2007) Environ. Sci. Technol , vol.41 , pp. 1159-1165
    • Wang, L.C.1    Chang-Chien, G.P.2
  • 5
    • 33746191781 scopus 로고    scopus 로고
    • Occurrence of polybrominated biphenyls, polybrominated dibenzo-p-dioxins, and polybrominated dibenzofurans as impurities in commercial polybrominated diphenyl ether mixtures
    • Hanari, N.; Kannan, K.; Miyake, Y.; Okazawa, T.; Kodavanti, P. R. S.; Aldous, K. M.; Yamashita, N. Occurrence of polybrominated biphenyls, polybrominated dibenzo-p-dioxins, and polybrominated dibenzofurans as impurities in commercial polybrominated diphenyl ether mixtures. Environ. Sci. Technol. 2006, 40, 4400-4405.
    • (2006) Environ. Sci. Technol , vol.40 , pp. 4400-4405
    • Hanari, N.1    Kannan, K.2    Miyake, Y.3    Okazawa, T.4    Kodavanti, P.R.S.5    Aldous, K.M.6    Yamashita, N.7
  • 7
    • 0242319565 scopus 로고    scopus 로고
    • Health effects of polybrominated dibenzo-p-dioxins (PBDDs) and dibenzofurans (PBDFs)
    • Birnbaum, L. S.; Staskal, D. F.; Diliberto, J. J. Health effects of polybrominated dibenzo-p-dioxins (PBDDs) and dibenzofurans (PBDFs). Environ. Int. 2003, 29, 855-860.
    • (2003) Environ. Int , vol.29 , pp. 855-860
    • Birnbaum, L.S.1    Staskal, D.F.2    Diliberto, J.J.3
  • 9
    • 0008787796 scopus 로고    scopus 로고
    • World Health Organization: Geneva, Accessed: Jan, 2008
    • Polybrominated Dibenzo-P-Dioxins and Furans; World Health Organization: Geneva, 1998; http://inchem.org/documents/ehc/ehc/ehc205.htm (Accessed: Jan, 2008).
    • (1998) Polybrominated Dibenzo-P-Dioxins and Furans
  • 12
    • 34250628103 scopus 로고    scopus 로고
    • Principles of QSAR models validation: Internal and external
    • Gramatica, P. Principles of QSAR models validation: internal and external. QSAR Comb. Sci. 2007, 26, 694-670.
    • (2007) QSAR Comb. Sci , vol.26 , pp. 694-670
    • Gramatica, P.1
  • 13
    • 48249109616 scopus 로고    scopus 로고
    • OW) Data for Hydrophobic Organic Compounds: DDT and DDE As a Case Study, Water-Resources Investigations Report 01-4201; U.S. Geological Survey: Reston, VA, 2001.
    • OW) Data for Hydrophobic Organic Compounds: DDT and DDE As a Case Study, Water-Resources Investigations Report 01-4201; U.S. Geological Survey: Reston, VA, 2001.
  • 14
    • 0032889704 scopus 로고    scopus 로고
    • go) of 106 polychlorinated diphenyl ethers (PCDE)
    • go) of 106 polychlorinated diphenyl ethers (PCDE). Chemosphere 1999, 38, 573-586.
    • (1999) Chemosphere , vol.38 , pp. 573-586
    • Kurz, J.1    Ballschmiter, K.2
  • 15
    • 33751052276 scopus 로고    scopus 로고
    • OW estimation methods for highly hydrophobic organic compounds: Polybrominated diphenyl ethers and hexabromocyclododecane
    • OW estimation methods for highly hydrophobic organic compounds: polybrominated diphenyl ethers and hexabromocyclododecane. Environ. Toxicol. Chem. 2006, 25, 2018-2027.
    • (2006) Environ. Toxicol. Chem , vol.25 , pp. 2018-2027
    • Hayward, S.J.1    Lei, Y.D.2    Wania, F.3
  • 16
    • 0023399173 scopus 로고
    • Correlation of octanol water partition-coefficients and total molecular-surface area for highly hydrophobic aromatic-compounds
    • Doucette, W. J.; Andren, A. W. Correlation of octanol water partition-coefficients and total molecular-surface area for highly hydrophobic aromatic-compounds. Environ. Sci. Technol. 1987, 21, 821-824.
    • (1987) Environ. Sci. Technol , vol.21 , pp. 821-824
    • Doucette, W.J.1    Andren, A.W.2
  • 18
    • 0034253964 scopus 로고    scopus 로고
    • Measurements of octanol-air partition coefficients for PCDD/Fs: A tool in assessing air-soil equilibrium status
    • Harner, T.; Green, N. J. L.; Jones, K. C. Measurements of octanol-air partition coefficients for PCDD/Fs: A tool in assessing air-soil equilibrium status. Environ. Sci. Technol. 2000, 34, 3109-3114.
    • (2000) Environ. Sci. Technol , vol.34 , pp. 3109-3114
    • Harner, T.1    Green, N.J.L.2    Jones, K.C.3
  • 19
    • 0036500736 scopus 로고    scopus 로고
    • OA) for polybrominated diphenyl ethers (PBDEs): Predicting partitioning in the environment
    • OA) for polybrominated diphenyl ethers (PBDEs): Predicting partitioning in the environment. J. Chem. Eng. Data 2002, 47, 228-232.
    • (2002) J. Chem. Eng. Data , vol.47 , pp. 228-232
    • Harner, T.1    Shoeib, M.2
  • 20
    • 0037098912 scopus 로고    scopus 로고
    • Estimating octanol-air partition coefficients of nonpolar semivolatile organic compounds from gas chromatographic retention times
    • Wania, F.; Lei, Y. D.; Harner, T. Estimating octanol-air partition coefficients of nonpolar semivolatile organic compounds from gas chromatographic retention times. Anal. Chem. 2002, 74, 3476-3483.
    • (2002) Anal. Chem , vol.74 , pp. 3476-3483
    • Wania, F.1    Lei, Y.D.2    Harner, T.3
  • 21
    • 0042790926 scopus 로고    scopus 로고
    • Octanol/air partitioning of polychlorinated biphenyls
    • Kömp, P.; McLachlan, M. S. Octanol/air partitioning of polychlorinated biphenyls. Environ. Toxicol. Chem. 1997, 16, 2433-2437.
    • (1997) Environ. Toxicol. Chem , vol.16 , pp. 2433-2437
    • Kömp, P.1    McLachlan, M.S.2
  • 22
    • 0036566740 scopus 로고    scopus 로고
    • OA) values for chlorobenzenes and polychlorinated naphthalenes from gas chromatographic retention times
    • OA) values for chlorobenzenes and polychlorinated naphthalenes from gas chromatographic retention times. J. Chem. Eng. Data 2002, 47, 449-455.
    • (2002) J. Chem. Eng. Data , vol.47 , pp. 449-455
    • Su, Y.S.1    Lei, Y.D.2    Daly, G.L.3    Wania, F.4
  • 23
    • 0031648490 scopus 로고    scopus 로고
    • Measurement of octanol-air partition coefficients for polycyclic aromatic hydrocarbons and polychlorinated naphthalenes
    • Harner, T.; Bidleman, T. F. Measurement of octanol-air partition coefficients for polycyclic aromatic hydrocarbons and polychlorinated naphthalenes. J. Chem. Eng. Data 1998, 43, 40-46.
    • (1998) J. Chem. Eng. Data , vol.43 , pp. 40-46
    • Harner, T.1    Bidleman, T.F.2
  • 24
    • 47349098868 scopus 로고    scopus 로고
    • ConGENER - A tool for modeling of the congeneric sets of environmental pollutants
    • DOI: 10.1002/qsar.200710149
    • Haranczyk, M.; Puzyn, T.; Sadowski, P. ConGENER - A tool for modeling of the congeneric sets of environmental pollutants. QSAR Comb. Sci. 2008, DOI: 10.1002/qsar.200710149.
    • (2008) QSAR Comb. Sci
    • Haranczyk, M.1    Puzyn, T.2    Sadowski, P.3
  • 25
    • 48249114849 scopus 로고    scopus 로고
    • Stewart, J. J. P. MOPAC2007, ver. 7.065W; Stewart Computational Chemistry 2007;, Accessed: Jan, 2008
    • Stewart, J. J. P. MOPAC2007, ver. 7.065W; Stewart Computational Chemistry 2007; http://OpenMOPAC.net (Accessed: Jan, 2008).
  • 26
    • 47349097011 scopus 로고    scopus 로고
    • Calculation of quantum-mechanical descriptors for QSPR at the DFT level: Is it necessary?
    • DOI: 10/1021/ci800021p
    • Puzyn, T.; Suzuki, N.; Haranczyk, M.; Rak, J. Calculation of quantum-mechanical descriptors for QSPR at the DFT level: Is it necessary? J. Chem. Inf. Model. 2008, DOI: 10/1021/ci800021p.
    • (2008) J. Chem. Inf. Model
    • Puzyn, T.1    Suzuki, N.2    Haranczyk, M.3    Rak, J.4
  • 27
    • 0018709674 scopus 로고
    • Chance factors in studies of quantitative structure-activity relationships
    • Topliss, J. G.; Edwards, R. P. Chance factors in studies of quantitative structure-activity relationships. J. Med. Chem. 1979, 22, 1238-1244.
    • (1979) J. Med. Chem , vol.22 , pp. 1238-1244
    • Topliss, J.G.1    Edwards, R.P.2
  • 28
    • 84944178665 scopus 로고
    • Hierarchical Grouping to Optimize an Objective Function
    • Ward, J. H. Hierarchical Grouping to Optimize an Objective Function. J. Am. Stat. Assoc. 1963, 58, 236-244.
    • (1963) J. Am. Stat. Assoc , vol.58 , pp. 236-244
    • Ward, J.H.1
  • 29
    • 31144432913 scopus 로고    scopus 로고
    • Potential of degradable organic chemicals for absolute and relative enrichment in the arctic
    • Wania, F. Potential of degradable organic chemicals for absolute and relative enrichment in the arctic. Environ. Sci. Technol. 2006, 40, 569-577.
    • (2006) Environ. Sci. Technol , vol.40 , pp. 569-577
    • Wania, F.1
  • 30
    • 0344413414 scopus 로고    scopus 로고
    • Molecular polarizability as a single-parameter predictor of vapour pressures and octanol-air partitioning coefficients of non-polar compounds: A priori approach and results
    • Staikova, M.; Wania, F.; Donaldson, D. J. Molecular polarizability as a single-parameter predictor of vapour pressures and octanol-air partitioning coefficients of non-polar compounds: a priori approach and results. Atmos. Environ. 2004, 38, 213-225.
    • (2004) Atmos. Environ , vol.38 , pp. 213-225
    • Staikova, M.1    Wania, F.2    Donaldson, D.J.3
  • 31
    • 0036443423 scopus 로고    scopus 로고
    • Prediction of vapour pressures for halogenated diphenyl ether congeners from molecular descriptors
    • Öberg, T. Prediction of vapour pressures for halogenated diphenyl ether congeners from molecular descriptors. Environ. Sci. Pollut. Res. 2002, 9, 405-411.
    • (2002) Environ. Sci. Pollut. Res , vol.9 , pp. 405-411
    • Öberg, T.1
  • 32
    • 0036686939 scopus 로고    scopus 로고
    • Quantitative structure-property relationships for octanol-air partition coefficients of polychlorinated biphenyls
    • Chen, J.; Xue, X.; Schramm, K.-W.; Quan, X.; Yang, F.; Kettrup, A. Quantitative structure-property relationships for octanol-air partition coefficients of polychlorinated biphenyls. Chemosphere 2002, 48, 535-544.
    • (2002) Chemosphere , vol.48 , pp. 535-544
    • Chen, J.1    Xue, X.2    Schramm, K.-W.3    Quan, X.4    Yang, F.5    Kettrup, A.6
  • 33
    • 34047247358 scopus 로고    scopus 로고
    • L) of 209 polychlorinated diphenyl ethers (PCDEs) by DFT and the position of Cl substitution (PCS) methods
    • L) of 209 polychlorinated diphenyl ethers (PCDEs) by DFT and the position of Cl substitution (PCS) methods. Atmos. Environ. 2007, 41, 3590-3603.
    • (2007) Atmos. Environ , vol.41 , pp. 3590-3603
    • Zeng, X.L.1    Wang, Z.Y.2    Ge, Z.G.3    Liu, H.X.4
  • 34
    • 85138926398 scopus 로고    scopus 로고
    • Netzeva, T. I.; Worth, A.; Aldenberg, T.; Benigni, R.; Cronin, M. T.; Gramatica, P.; Jaworska, J. S.; Kahn, S.; Klopman, G.; Marchant, C. A.; Myatt, G.; Nikolova-Jeliazkova, N.; Patlewicz, G. Y.; Perkins, R.; Roberts, D.; Schultz, T.; Stanton, D. W.; van de Sandt, J. J.; Tong, W.; Veith, G.; Yang, C. Current Status of methods for defining the applicability domain of (quantitative) structure-activity relationships. The report and recommendations of ECVAM Workshop 52. ATLA - Altern. Lab. Anim. 2005, 33, 155-173.
    • Netzeva, T. I.; Worth, A.; Aldenberg, T.; Benigni, R.; Cronin, M. T.; Gramatica, P.; Jaworska, J. S.; Kahn, S.; Klopman, G.; Marchant, C. A.; Myatt, G.; Nikolova-Jeliazkova, N.; Patlewicz, G. Y.; Perkins, R.; Roberts, D.; Schultz, T.; Stanton, D. W.; van de Sandt, J. J.; Tong, W.; Veith, G.; Yang, C. Current Status of methods for defining the applicability domain of (quantitative) structure-activity relationships. The report and recommendations of ECVAM Workshop 52. ATLA - Altern. Lab. Anim. 2005, 33, 155-173.
  • 35
    • 0036888362 scopus 로고    scopus 로고
    • Estimating the contribution of degradation in air and deposition to the deep sea to the global loss of PCBs
    • Wania, F.; Daly, G. L. Estimating the contribution of degradation in air and deposition to the deep sea to the global loss of PCBs. Atmos. Environ. 2002, 36, 5581-5593.
    • (2002) Atmos. Environ , vol.36 , pp. 5581-5593
    • Wania, F.1    Daly, G.L.2
  • 36
    • 0345550273 scopus 로고    scopus 로고
    • Evidence for the "grasshopper" effect and fractionation during long-range atmospheric transport of organic contaminants
    • Gouin, T.; Mackay, D.; Jones, K. C.; Harner, T.; Meijer, S. N. Evidence for the "grasshopper" effect and fractionation during long-range atmospheric transport of organic contaminants. Environ. Pollut. 2004, 128, 139-148.
    • (2004) Environ. Pollut , vol.128 , pp. 139-148
    • Gouin, T.1    Mackay, D.2    Jones, K.C.3    Harner, T.4    Meijer, S.N.5
  • 37
    • 0344256460 scopus 로고    scopus 로고
    • Modeling transport and deposition of contaminants to ecosystems of concern: A case study for the Laurentian Great Lakes
    • MacLeod, M.; Mackay, D. Modeling transport and deposition of contaminants to ecosystems of concern: a case study for the Laurentian Great Lakes. Environ. Pollut. 2004, 128, 241-250.
    • (2004) Environ. Pollut , vol.128 , pp. 241-250
    • MacLeod, M.1    Mackay, D.2
  • 38
    • 1842782842 scopus 로고    scopus 로고
    • Bioaccumulation potential of persistent organic chemicals in humans
    • Czub, G.; McLachlan, M. S. Bioaccumulation potential of persistent organic chemicals in humans. Environ. Sci. Technol. 2004, 38, 2406-2412.
    • (2004) Environ. Sci. Technol , vol.38 , pp. 2406-2412
    • Czub, G.1    McLachlan, M.S.2
  • 39
    • 0033961083 scopus 로고    scopus 로고
    • Polychlorinated dibenzo-p-dioxins and dibenzofurans in sediment, soil, fish, shellfish and crab samples from Tokyo Bay area, Japan
    • Sakurai, T.; Kim, J. G.; Suzuki, N.; Matsuo, T.; Li, D. Q.; Yao, Y. A.; Masunaga, S.; Nakanishi, J. Polychlorinated dibenzo-p-dioxins and dibenzofurans in sediment, soil, fish, shellfish and crab samples from Tokyo Bay area, Japan. Chemosphere 2000, 40, 627-640.
    • (2000) Chemosphere , vol.40 , pp. 627-640
    • Sakurai, T.1    Kim, J.G.2    Suzuki, N.3    Matsuo, T.4    Li, D.Q.5    Yao, Y.A.6    Masunaga, S.7    Nakanishi, J.8


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.