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: | 1500 | |
|---|---|---|
| Name: | 8-methylnonan-1-ol | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Isodecanol | |
| Labels: | ||
| CAS: | 68526-85-2 | |
| InChi Code: | InChI=1S/C10H22O/c1-10(2)8-6-4-3-5-7-9-11/h10-11H,3-9H2,1-2H3 |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 0.585825461 |
experimental value |
| -0.9114 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |