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- W2124276345 abstract "The partition coefficient (P) of some mono- and di-ortho- substituted aromatic compounds was measured in a 1-octanol/water system. For each series of compounds with the same functional group, the n-value (the difference in the log Rvalue between the substituted and unsubstituted compound) was analyzed on the same basis as the values of meta- and para-substituted isomers by an extended Hammett -Taft procedure. In the procedure, we considered the intramolecular electronic and steric effects, operating between substituents and governing the relative hydrogen-bonding solvation with partitioning solvents for solutes in which internal hydrogen-bond formation can be ignored. The TT value for mono- and di-ortho-substituted derivatives was adequately included in the correlation equation for the values of the meta- and para- substituted derivatives in each series. The effect of di-ortho substituents on partition behaviors could be roughly expressed by the sum of the effects of the 2- and 6-position substituents." @default.
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- W2124276345 date "1993-08-01" @default.
- W2124276345 modified "2023-09-25" @default.
- W2124276345 title "Octanol/Water Partition Coefficient of Ortho-Substituted Aromatic Solutes" @default.
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- W2124276345 doi "https://doi.org/10.1002/jps.2600820804" @default.
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