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: | 577 | |
|---|---|---|
| Name: | Captafol | |
| Description: | ||
| Labels: | training, Organic_sulfides | |
| CAS: | 2939-80-2 | |
| InChi Code: | InChI=1S/C10H9Cl4NO2S/c11-9(12)10(13,14)18-15-7(16)5-3-1-2-4-6(5)8(15)17/h1-2,5-6,9H,3-4H2 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 3.32 |
experimental value |
| 2.39 |
Eq1: Linear correlation with logP (Training set) |
| 2.31 |
Eq2: Non-linear regression model (Training set) |
| 2.31 |
Eq3: Non-linear regression model with correction factors (Training set) |