Abraham Michael H, Zhao Yuan H
Department of Chemistry, University College London, 20 Gordon Street, London, UK.
Phys Chem Chem Phys. 2005 Jun 21;7(12):2418-22. doi: 10.1039/b502058a. Epub 2005 May 19.
The Abraham linear free energy relationship, or solvation equation, has been applied to literature data on the partition of nonelectrolytes in the water to o-nitrophenyl octyl ether (NPOE) system. The resulting equation is compared to equations for other water to solvent systems using the D-parameter of Abraham and Martins and the theta-parameter of Ishihama and Asakawa. It is shown that as a solvent in partitioning systems, NPOE quite resembles nitrobenzene and 1,2-dichloroethane, and that the latter does not resemble an alkane-like solvent. Using descriptors for simple ions that we have previously obtained, we show that ions and nonelectrolytes can be included in the same linear free energy relationship.