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: | 448 | |
|---|---|---|
| Name: | Methabenzthiazuron | |
| Description: | ||
| Labels: | training, Aromatic_Heterocycles | |
| CAS: | 18691-97-9 | |
| InChi Code: | InChI=1S/C10H11N3OS/c1-11-9(14)13(2)10-12-7-5-3-4-6-8(7)15-10/h3-6H,1-2H3,(H,11,14) |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.8 |
experimental value |
| 1.98 |
Eq1: Linear correlation with logP (Training set) |
| 1.98 |
Eq2: Non-linear regression model (Training set) |
| 1.98 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID0037570 | US EPA CompTox Dashboard |