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:189
Name:2,4-Dichlorophenoxyaceticacid
Description:
Labels:training, Organic_acids
CAS:94-75-7
InChi Code:InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
1.66

experimental value

2.38

Eq1: Linear correlation with logP (Training set)

2.30

Eq2: Non-linear regression model (Training set)

1.9

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