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: | 464 | |
|---|---|---|
| Name: | Benz[a]acridine | |
| Description: | ||
| Labels: | training, Polyaromatic_heterocycles | |
| CAS: | 225-11-6 | |
| InChi Code: | InChI=1S/C17H11N/c1-3-7-14-12(5-1)9-10-17-15(14)11-13-6-2-4-8-16(13)18-17/h1-11H |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 4.39 |
experimental value |
| 3.74 |
Eq1: Linear correlation with logP (Training set) |
| 3.71 |
Eq2: Non-linear regression model (Training set) |
| 4.68 |
Eq3: Non-linear regression model with correction factors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID9075371 | US EPA CompTox Dashboard |