10967/159 - QDB Compounds

QsarDB Repository

Wen, Y.; Su, L. M.; Qin, W. C.; Fu, L.; He, J.; Zhao, Y. H. Linear and non-linear relationships between soil sorption and hydrophobicity: Model, validation and influencing factors. Chemosphere 2012, 86, 634–640.

Compound

ID:232
Name:Biphenyl
Description:
Labels:training, Biphenyls
CAS:92-52-4
InChi Code:InChI=1S/C12H10/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
3.27

experimental value

3.28

Eq1: Linear correlation with logP (Training set)

3.18

Eq2: Non-linear regression model (Training set)

3.18

Eq3: Non-linear regression model with correction factors (Training set)

Links to External Resources