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: | 570 | |
|---|---|---|
| Name: | 4,4'-Thiodianiline | |
| Description: | ||
| Labels: | training, Organic_sulfides | |
| CAS: | 139-65-1 | |
| InChi Code: | InChI=1S/C12H12N2S/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,13-14H2 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.04 |
experimental value |
| 2.11 |
Eq1: Linear correlation with logP (Training set) |
| 2.07 |
Eq2: Non-linear regression model (Training set) |
| 2.07 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID9021344 | US EPA CompTox Dashboard |