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: | 588 | |
|---|---|---|
| Name: | Nitralin | |
| Description: | ||
| Labels: | training, Sulfone_derivatives | |
| CAS: | 4726-14-1 | |
| InChi Code: | InChI=1S/C13H19N3O6S/c1-4-6-14(7-5-2)13-11(15(17)18)8-10(23(3,21)22)9-12(13)16(19)20/h8-9H,4-7H2,1-3H3 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.92 |
experimental value |
| 2.94 |
Eq1: Linear correlation with logP (Training set) |
| 2.82 |
Eq2: Non-linear regression model (Training set) |
| 2.82 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID9042203 | US EPA CompTox Dashboard |