Ran, Y.; He, Y.; Yang, G.; Johnson, J. L. H.; Yalkowsky, S. H. Estimation of aqueous solubility of organic compounds by using the general solubility equation. Chemosphere 2002, 48, 487–509.
Compound
| ID: | 298 | |
|---|---|---|
| Name: | 1,3,5-Trichlorobenzene | |
| Description: | ||
| Labels: | ||
| CAS: | 108-70-3 | |
| InChi Code: | InChI=1S/C6H3Cl3/c7-4-1-5(8)3-6(9)2-4/h1-3H |
Properties
MlogP: Measured octanol/water partition coefficient as logP
| Value | Source or prediction |
|---|---|
| 4.19 |
experimental value |
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| -4.48 |
experimental value |
| -4.18 |
Eq.1: General solubility equation (Test set to verify GSE) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID8026195 | US EPA CompTox Dashboard |