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: | 661 | |
|---|---|---|
| Name: | 4,4'-Methylene dianiline | |
| Description: | ||
| Labels: | validation, Other_compounds | |
| CAS: | 101-77-9 | |
| InChi Code: | InChI=1S/C13H14N2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h1-8H,9,14-15H2 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 1.99 |
experimental value |
| 2.16 |
Eq1: Linear correlation with logP (Validation set) |
| 2.12 |
Eq2: Non-linear regression model (Validation set) |
| 2.12 |
Eq3: Non-linear regression model with correction factors (Validation set) |