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: | 522 | |
|---|---|---|
| Name: | Kitazin | |
| Description: | ||
| Labels: | training, Organic_phosphides | |
| CAS: | 13286-32-3 | |
| InChi Code: | InChI=1S/C11H17O3PS/c1-3-13-15(12,14-4-2)16-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.4 |
experimental value |
| 2.98 |
Eq1: Linear correlation with logP (Training set) |
| 2.87 |
Eq2: Non-linear regression model (Training set) |
| 2.87 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID0074502 | US EPA CompTox Dashboard |