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:139
Name:2,4-Dichlorophenol
Description:
Labels:training, Phenols
CAS:120-83-2
InChi Code:InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
2.81

experimental value

2.72

Eq1: Linear correlation with logP (Training set)

2.61

Eq2: Non-linear regression model (Training set)

2.61

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

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