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: | 1179 | |
|---|---|---|
| Name: | (2R)-1-(ethenyloxy)-2-ethylhexane | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 2-ethylhexylvinylether | |
| Labels: | ||
| CAS: | 103-44-6 | |
| InChi Code: | InChI=1S/C10H20O/c1-4-7-8-10(5-2)9-11-6-3/h6,10H,3-5,7-9H2,1-2H3/t10-/m1/s1 |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 0.950825461 |
experimental value |
| 0.1025 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |