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: | 149 | |
|---|---|---|
| Name: | 3,4,5-Trichloroguaiacol | |
| Description: | ||
| Labels: | training, Phenols | |
| CAS: | 57057-83-7 | |
| InChi Code: | InChI=1S/C7H5Cl3O2/c1-12-7-4(11)2-3(8)5(9)6(7)10/h2,11H,1H3 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.8 |
experimental value |
| 3.24 |
Eq1: Linear correlation with logP (Training set) |
| 3.14 |
Eq2: Non-linear regression model (Training set) |
| 3.14 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7052232 | US EPA CompTox Dashboard |