Determination and prediction of K(ow) and dimensionless Henry’s constant (H) for 6 ether compounds at several temperatures

In-Chan Hwang; Hae-yeon Kwak; So-Jin Park

Journal of Industrial and Engineering Chemistry, Vol.16, No.4, 629-633, July, 2010

DOI10.1016/j.jiec.2010.03.003 Export Citation

Determination and prediction of K(ow) and dimensionless Henry’s constant (H) for 6 ether compounds at several temperatures

In-Chan Hwang, Hae-yeon Kwak, and So-Jin Park^†

Department of Chemical Engineering, Chungnam National University, Daejeon 305-764, Republic of Korea

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The octanol.water partition coefficient (K(ow)) and air.water partition coefficient (K(aw)) as well as the dimensionless Henry’s constant (H) are used to calculate the transport and fate of chemicals in the environment or eco-system. In this work, the K(ow) and the H weremeasured for 6 ether compounds; di-nbutyl ether (DBE), di-isopropyl ether (DIPE), tert-butyl ethyl ether (ETBE), tert-butyl methyl ether (MTBE), propyl vinyl ether (PVE) and tert-amyl methyl ether (TAME) at 4 different temperatures. The K(ow) was directly measured by using a conventional slow stirring (SS) method, while the H was measured using headspace gas chromatography (HSGC). Additionally, the measured K(ow) and H values were compared with the predicted values by the fragment constant method or HENRYWIN program approaches.

Keywords:6 Ether compounds;K(ow);K(aw);Henry’s constant;HENRYWIN program

[References]

Mackay D, Multimedia Environmental Models. The Fugacity Approach, Lewis Publishers (1991)
Mackay D, Shiu WY, J. Phys. Chem. Ref. Data., 10, 1175 (1981)
Swann RL, Laskoski DA, McCall PJ, Vander KK, Dishburger HJ, Residue Reviews 85, Springer-Verlag, NewTouk. Inc. (1983)
Sarraute S, Delepine H, Costa Gomes MF, Majer V, Chemosphere., 57, 1543 (2004)
Han SD, Park SJ, Park SJ, HWAHAK KONGHAK, 35(1), 96 (1997)
DeVoe H, Miller MM, Wasik SP, J. Res. Nat. Bur. Stand., 86, 361 (1981)
Woodburn KB, Doucette WJ, Andren AW, Environ. Sci. Technol., 18, 457 (1984)
Bruijn JD, Busser F, Seinen W, Hermens J, Environ. Toxicol. Chem., 8, 499 (1989)
Park YS, Park SJ, J. Korean Ind. Eng. Chem., 11(7), 773 (2000)
Gossett JM, Environ. Sci. Technol., 21, 202 (1987)
Hussam A, Carr PW, Anal. Chem., 57, 793 (1985)
Park SJ, Back JM, J. Ind. Eng. Chem., 6(2), 100 (2000)
Xuejun C, Jianhang Z, Dongzhi W, Hur BK, J. Ind. Eng. Chem., 8(3), 203 (2002)
Fujita T, Iwasa J, hansch D, J. Am. Chem. Soc., 86, 5175 (1964)
Hine J, Mookerjee PK, J. Org. Chem., 40, 292 (1975)
Park SJ, Lim HY, Park SJ, Korean Chem. Eng. Res., 42(1), 65 (2004)
Park SJ, Park SJ, J. Korean Ind. Eng. Chem., 15(8), 967 (2004)
Atlan S, Trelea IC, Souchon AI, Latrille E, J. Chromatogr. A., 1110, 146 (2006)
Bakierowska AM, Trzeszczynski J, Fluid Phase Equilib., 213(1-2), 139 (2003)
Dortmund Data bank (DDB) overview, DDB data directory, version 2006 (http://www.ddbst.de).

[Referenced By]

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[1] Mackay D, Multimedia Environmental Models. The Fugacity Approach, Lewis Publishers (1991)

[2] Mackay D, Shiu WY, J. Phys. Chem. Ref. Data., 10, 1175 (1981)

[3] Swann RL, Laskoski DA, McCall PJ, Vander KK, Dishburger HJ, Residue Reviews 85, Springer-Verlag, NewTouk. Inc. (1983)

[4] Sarraute S, Delepine H, Costa Gomes MF, Majer V, Chemosphere., 57, 1543 (2004)

[5] Han SD, Park SJ, Park SJ, HWAHAK KONGHAK, 35(1), 96 (1997)

[6] DeVoe H, Miller MM, Wasik SP, J. Res. Nat. Bur. Stand., 86, 361 (1981)

[7] Woodburn KB, Doucette WJ, Andren AW, Environ. Sci. Technol., 18, 457 (1984)

[8] Bruijn JD, Busser F, Seinen W, Hermens J, Environ. Toxicol. Chem., 8, 499 (1989)

[9] Park YS, Park SJ, J. Korean Ind. Eng. Chem., 11(7), 773 (2000)

[10] Gossett JM, Environ. Sci. Technol., 21, 202 (1987)

[11] Hussam A, Carr PW, Anal. Chem., 57, 793 (1985)

[12] Park SJ, Back JM, J. Ind. Eng. Chem., 6(2), 100 (2000)

[13] Xuejun C, Jianhang Z, Dongzhi W, Hur BK, J. Ind. Eng. Chem., 8(3), 203 (2002)

[14] Fujita T, Iwasa J, hansch D, J. Am. Chem. Soc., 86, 5175 (1964)

[15] Hine J, Mookerjee PK, J. Org. Chem., 40, 292 (1975)

[16] Park SJ, Lim HY, Park SJ, Korean Chem. Eng. Res., 42(1), 65 (2004)

[17] Park SJ, Park SJ, J. Korean Ind. Eng. Chem., 15(8), 967 (2004)

[18] Atlan S, Trelea IC, Souchon AI, Latrille E, J. Chromatogr. A., 1110, 146 (2006)

[19] Bakierowska AM, Trzeszczynski J, Fluid Phase Equilib., 213(1-2), 139 (2003)

[20] Dortmund Data bank (DDB) overview, DDB data directory, version 2006 (http://www.ddbst.de).