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:152
Name:1-Naphthol
Description:
Labels:training, Phenols
CAS:90-15-3
InChi Code:InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
2.72

experimental value

2.57

Eq1: Linear correlation with logP (Training set)

2.47

Eq2: Non-linear regression model (Training set)

2.47

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

Links to External Resources