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:381
Name:Carbofuran
Description:
Labels:training, Phenylcarbamates
CAS:1563-66-2
InChi Code:InChI=1S/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
1.75

experimental value

2.23

Eq1: Linear correlation with logP (Training set)

2.17

Eq2: Non-linear regression model (Training set)

2.17

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

Links to External Resources