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:628
Name:4-Biphenylmethanol
Description:
Labels:validation, Other_compounds
CAS:3597-91-9
InChi Code:InChI=1S/C13H12O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,14H,10H2

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
2.54

experimental value

2.58

Eq1: Linear correlation with logP (Validation set)

2.48

Eq2: Non-linear regression model (Validation set)

2.48

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

Links to External Resources