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:637
Name:Benzaloxime-N-methylcarbamate
Description:
Labels:validation, Other_compounds
CAS:2426-12-2
InChi Code:InChI=1S/C9H10N2O2/c1-13-9(12)11-10-7-8-5-3-2-4-6-8/h2-7H,1H3,(H,11,12)

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
1.8

experimental value

1.88

Eq1: Linear correlation with logP (Validation set)

1.9

Eq2: Non-linear regression model (Validation set)

1.90

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