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: | 170 | |
|---|---|---|
| Name: | 2,3,5,6-Tetrachloroaniline | |
| Description: | ||
| Labels: | training, Anilines | |
| CAS: | 3481-20-7 | |
| InChi Code: | InChI=1S/C6H3Cl4N/c7-2-1-3(8)5(10)6(11)4(2)9/h1H,11H2 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 3.94 |
experimental value |
| 3.37 |
Eq1: Linear correlation with logP (Training set) |
| 3.28 |
Eq2: Non-linear regression model (Training set) |
| 3.28 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID2022208 | US EPA CompTox Dashboard |