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: | 751 | |
|---|---|---|
| Name: | Cyclohexyl acetate | |
| Description: | Name was changed from Cyclohexanol acetate to Cyclohexyl acetate | |
| Labels: | ||
| CAS: | 622-45-7 | |
| InChi Code: | InChI=1S/C8H14O2/c1-7(9)10-8-5-3-2-4-6-8/h8H,2-6H2,1H3 |
Properties
logSobs: Aqueous solubility as logS [mol/L]
| Value | Source or prediction |
|---|---|
| -1.67 |
experimental value |
| -1.71 |
Eq.1: General solubility equation (Test set to verify GSE) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID6052299 | US EPA CompTox Dashboard |