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: | 253 | |
|---|---|---|
| Name: | 1,1,3-Trimethylcyclohexane | |
| Description: | ||
| Labels: | ||
| CAS: | 3073-66-3 | |
| InChi Code: | InChI=1S/C9H18/c1-8-5-4-6-9(2,3)7-8/h8H,4-7H2,1-3H3 |
Properties
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| -4.85 |
experimental value |
| -4.41 |
Eq.1: General solubility equation (Test set to verify GSE) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID60858746 | US EPA CompTox Dashboard |