Evaluating dissolved organic carbon-water partitioning using polyparameter linear free energy relationships: Implications for the fate of disinfection by-products

Water Research

Volumn 46, Issue 11, 2012, Pages 3637-3645

  Neale, Peta A ^a   Escher, Beate I ^a   Goss, Kai Uwe ^b,c   Endo, Satoshi ^b  

^a UNIVERSITY OF QUEENSLAND   (Australia)

^b HELMHOLTZ CENTRE FOR ENVIRONMENTAL RESEARCH UFZ   (Germany)

^c MARTIN LUTHER UNIVERSITY HALLE WITTENBERG   (Germany)

Author keywords

Disinfection by products; Dissolved organic carbon; Fulvic acid; Partition coefficient; Polyparameter linear free energy relationship

Indexed keywords

BIOGEOCHEMISTRY; BIOLOGICAL MATERIALS; DISINFECTION; DISSOLUTION; HYDROGEN BONDS; ORGANIC ACIDS; RIVERS; STREAM FLOW;

DISINFECTION BY-PRODUCT; DISINFECTION BYPRODUCTS; DISSOLVED ORGANIC CARBON; FULVIC ACIDS; MICROPOLLUTANTS; ORGANIC CARBON-WATER PARTITIONING; PARTITION COEFFICIENT; POLYPARAMETER LINEAR FREE ENERGY RELATIONSHIPS; SUWANNEE RIVER FULVIC ACID; W-VALUE;

ORGANIC CARBON;

ALKANE DERIVATIVE; ALKENE DERIVATIVE; CARBON; DISINFECTANT AGENT; DISSOLVED ORGANIC CARBON; FULVIC ACID; HUMIC ACID; ORGANIC CARBON; TRIHALOMETHANE; UNCLASSIFIED DRUG;

CHEMICAL BONDING; DISINFECTION; DISSOLVED ORGANIC CARBON; EXPERIMENTAL STUDY; HUMIC ACID; HYDROGEN; PARTITION COEFFICIENT; RIVER POLLUTION; RIVER SYSTEM; SORPTION; TOXICITY;

ARTICLE; ENERGY; EVALUATION; HYDROGEN BOND; MOLECULAR INTERACTION; PARTITION COEFFICIENT; POLLUTANT; PRIORITY JOURNAL; RIVER; SOLID PHASE MICROEXTRACTION; STATISTICAL MODEL; THERMODYNAMICS; WATER PARTITION COEFFICIENT;

SUWANNEE RIVER; UNITED STATES;

EID: 84861334949     PISSN: 00431354     EISSN: 18792448     Source Type: Journal    
DOI: 10.1016/j.watres.2012.04.005     Document Type: Article

References (38)

1. Abraham M.H., Andonian-Haftvan J., Whiting G.S., Leo A., Taft R.S. Hydrogen bonding. Part 34. The factors that influence the solubility of gases and vapours in water at 298 K, and a new method for its determination. Journal of the Chemical Society-Perkin Transactions 1994, 2(8):1777-1791.
2. Abraham M.H., Chadha H.S., Dixon J.P., Leo A.J. Hydrogen-bonding. 39. The partition of solutes between water and various alcohols. Journal of Physical Organic Chemistry 1994, 7(12):712-716.
3. Bronner G., Goss K.-U. Predicting sorption of pesticides and other multifunctional organic chemicals to soil organic carbon. Environmental Science & Technology 2011, 45(4):1313-1319.
4. Bronner G., Goss K.-U. Sorption of organic chemicals to soil organic matter: influence of soil variability and pH dependence. Environmental Science & Technology 2011, 45(4):1307-1312.
5. Burgess R.M., Pelletier M.C., Gundersen J.L., Perron M.M., Ryba S.A. Effects of different forms of organic carbon on the partitioning and bioavailability of nonylphenol. Environmental Toxicology and Chemistry 2005, 24(7):1609-1617.
6. Burkhard L.P. Estimating dissolved organic carbon partition coefficients for nonionic organic chemicals. Environmental Science & Technology 2000, 34(22):4663-4668.
7. Chen B., Seong-Nam N., Westerhoff P.K., Krasner S.W., Amy G. Fate of effluent organic matter and DBP precursors in an effluent-dominated river: a case study of wastewater impact on downstream water quality. Water Research 2009, 43(6):1755-1765.
8. Chin Y.P., Aiken G., O'Loughlin E. Molecular weight, polydispersity, and spectroscopic properties of aquatic humic substances. Environmental Science & Technology 1994, 28(11):1853-1858.
9. Chin Y.P., Aiken G.R., Danielsen K.M. Binding of pyrene to aquatic and commercial humic substances: the role of molecular weight and aromaticity. Environmental Science & Technology 1997, 31(6):1630-1635.
10. Chiou C.T., Malcolm R.L., Brinton T.I., Kile D.E. Water solubility enhancement of some organic pollutants and pesticides by dissolved humic and fulvic acids. Environmental Science & Technology 1986, 20(5):502-508.
11. Endo S., Droge S.T.J., Goss K.-U. Polyparameter linear free energy models for polyacrylate fiber-water partition coefficients to evaluate the efficiency of solid-phase microextraction. Analytical Chemistry 2011, 83(4):1394-1400.
12. Endo S., Grathwohl P., Haderlein S.B., Schmidt T.C. Effects of native organic material and water on sorption properties of reference diesel soot. Environmental Science & Technology 2009, 43(9):3187-3193.
13. OC) at environmentally relevant sorbate concentrations. Environmental Science & Technology 2009, 43(9):3094-3100.
14. Fono L.J., Kolodziej E.P., Sedlak D.L. Attenuation of wastewater-derived contaminants in an effluent-dominated river. Environmental Science & Technology 2006, 40(23):7257-7262.
15. Gauthier T.D., Shane E.C., Guerin W.F., Seitz W.R., Grant C.L. Fluorescence quenching method for determining equilibrium constants for polycyclic aromatic hydrocarbons binding to dissolved humic materials. Environmental Science & Technology 1986, 20(11):1162-1166.
16. Goss K.U., Schwarzenbach R.P. Linear free energy relationships used to evaluate equilibrium partitioning of organic compounds. Environmental Science & Technology 2001, 35(1):1-9.
17. Hawker D.W., Cumming J.L., Neale P.A., Bartkow M.E., Escher B.I. A screening level fate model of organic contaminants from advanced water treatment in a potable water supply reservoir. Water Research 2011, 45(2):768-780.
18. Kim S.-J., Kwon J.-H. Determination of partition coefficients for selected PAHs between water and dissolved organic matter. Clean - Soil, Air, Water 2010, 38(9):797-802.
19. Kipka U., Di Toro D.M. A linear solvation energy relationship model of organic chemical partitioning to dissolved organic carbon. Environmental Toxicology and Chemistry 2011, 30(9):2023-2029.
20. Krasner S.W., Weinberg H.S., Richardson S.D., Pastor S.J., Chinn R., Sclimenti M.J., Onstad G.D., Thruston A.D. Occurrence of a new generation of disinfection byproducts. Environmental Science & Technology 2006, 40(23):7175-7185.
21. Lam M.W., Mabury S.A. Photodegradation of the pharmaceuticals atorvastatin, carbamazepine, levofloxacin, and sulfamethoxazole in natural waters. Aquatic Sciences 2005, 67(2):177-188.
22. Malcolm R.L., MacCarthy P. Limitation in the use of commercial humic acids in water and soil research. Environmental Science & Technology 1986, 20(9):904-911.
23. Neale P.A., Antony A., Gernjak W., Leslie G., Escher B.I. Natural versus wastewater derived dissolved organic carbon: implications for the environmental fate of organic micropollutants. Water Research 2011, 45(14):4227-4237.
24. Niederer C., Goss K.-U., Schwarzenbach R.P. Sorption equilibrium of a wide spectrum of organic vapors in Leonardite humic acid: modeling of experimental data. Environmental Science & Technology 2006, 40(17):5374-5379.
25. Niederer C., Schwarzenbach R.P., Goss K.-U. Elucidating differences in the sorption properties of 10 humic and fulvic acids for polar and nonpolar organic chemicals. Environmental Science & Technology 2007, 41(19):6711-6717.
26. Pernet-Coudrier B., Clouzot L., Varrault G., Tusseau-Vuillemin M.H., Verger A., Mouchel J.M. Dissolved organic matter from treated effluent of a major wastewater treatment plant: characterization and influence on copper toxicity. Chemosphere 2008, 73(4):593-599.
27. Rosario-Ortiz F.L., Snyder S.A., Suffet I.H. Characterization of dissolved organic matter in drinking water sources impacted by multiple tributaries. Water Research 2007, 41(18):4115-4128.
28. Schlautman M.A., Morgan J.J. Effects of aqueous chemistry on the binding of polycyclic aromatic hydrocarbons by dissolved humic materials. Environmental Science & Technology 1993, 27(5):961-969.
29. Seol Y., Lee L.S. Effect of dissolved organic matter in treated effluents on sorption of atrazine and prometryn by soils. Soil Science Society of America Journal 2000, 64(6):1976-1983.
30. OC values for PAHs using fluorescence quenching. Environmental Science & Technology 1997, 31(2):424-429.
31. Uhle M.E., Chin Y.P., Aiken G.R., McKnight D.M. Binding of polychlorinated biphenyls to aquatic humic substances: the role of substrate and sorbate properties on partitioning. Environmental Science & Technology 1999, 33(16):2715-2718.
32. ® Windows, v4.0 2008, United States Environmental Protection Agency, Washington, DC, USA.
33. Villanueva C.M., Cantor K.P., Grimalt J.O., Malats N., Silverman D., Tardon A., Garcia-Closas R., Serra C., Carrato A., Castano-Vinyals G., Marcos R., Rothman N., Real F.X., Dosemeci M., Kogevinas M. Bladder cancer and exposure to water disinfection by-products through ingestion, bathing, showering, and swimming in pools. American Journal of Epidemiology 2007, 165(2):148-156.
34. Waller K., Swan S.H., DeLorenze G., Hopkins B. Trihalomethanes in drinking water and spontaneous abortion. Epidemiology 1998, 9(2):134-140.
35. Wang X., Guo X., Yang Y., Tao S., Xing B. Sorption mechanisms of phenanthrene, lindane, and atrazine with various humic acid fractions from a single soil sample. Environmental Science & Technology 2011, 45(6):2124-2130.
36. Weber E.J., Spidle D.L., Thorn K.A. Covalent binding of aniline to humic substances .1. Kinetic studies. Environmental Science & Technology 1996, 30(9):2755-2763.
37. Yamamoto H., Liljestrand H.M., Shimizu Y., Morita M. Effects of physical-chemical characteristics on the sorption of selected endocrine disruptors by dissolved organic matter surrogates. Environmental Science & Technology 2003, 37(12):2646-2657.
38. Ying G.-G., Kookana R.S., Kolpin D.W. Occurrence and removal of pharmaceutically active compounds in sewage treatment plants with different technologies. Journal of Environmental Monitoring 2009, 11(8):1498-1505.