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: | 445 | |
|---|---|---|
| Name: | Benomyl | |
| Description: | ||
| Labels: | training, Aromatic_Heterocycles | |
| CAS: | 17804-35-2 | |
| InChi Code: | InChI=1S/C14H18N4O3/c1-3-4-9-15-13(19)18-11-8-6-5-7-10(11)16-12(18)17-14(20)21-2/h5-8H,3-4,9H2,1-2H3,(H,15,19)(H,16,17,20) |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.71 |
experimental value |
| 2.43 |
Eq1: Linear correlation with logP (Training set) |
| 2.35 |
Eq2: Non-linear regression model (Training set) |
| 2.35 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID5023900 | US EPA CompTox Dashboard |