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: | 279 | |
|---|---|---|
| Name: | Indeno[1,2,3-cd]pyrene | |
| Description: | ||
| Labels: | training, PAHs | |
| CAS: | 193-39-5 | |
| InChi Code: | InChI=1S/C22H12/c1-2-7-17-16(6-1)18-11-10-14-9-8-13-4-3-5-15-12-19(17)22(18)21(14)20(13)15/h1-12H |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 6.2 |
experimental value |
| 5.35 |
Eq1: Linear correlation with logP (Training set) |
| 5.46 |
Eq2: Non-linear regression model (Training set) |
| 5.9 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID8024153 | US EPA CompTox Dashboard |