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: | 456 | |
|---|---|---|
| Name: | Dibenzothiophene | |
| Description: | ||
| Labels: | training, Polyaromatic_heterocycles | |
| CAS: | 132-65-0 | |
| InChi Code: | InChI=1S/C12H8S/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 4.05 |
experimental value |
| 3.6 |
Eq1: Linear correlation with logP (Training set) |
| 3.54 |
Eq2: Non-linear regression model (Training set) |
| 4.51 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID0047741 | US EPA CompTox Dashboard |