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: | 451 | |
|---|---|---|
| Name: | 2-Benzothiazolethiol | |
| Description: | ||
| Labels: | training, Aromatic_Heterocycles | |
| CAS: | 149-30-4 | |
| InChi Code: | InChI=1S/C7H5NS2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9) |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.25 |
experimental value |
| 2.38 |
Eq1: Linear correlation with logP (Training set) |
| 2.30 |
Eq2: Non-linear regression model (Training set) |
| 2.3 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID1020807 | US EPA CompTox Dashboard |