Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.
Compound
| ID: | 1351 | |
|---|---|---|
| Name: | heptylcyclohexane | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: n-heptyl cyclohexane | |
| Labels: | ||
| CAS: | 5617-41-4 | |
| InChi Code: | InChI=1S/C13H26/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h13H,2-12H2,1H3 |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 0.170825461 |
experimental value |
| 0.7512 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID1058636 | US EPA CompTox Dashboard |