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: | 1416 | |
|---|---|---|
| Name: | [(2-chloroethoxy)(phenyl)methyl]benzene | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 2-chloroethylbenzhydryl ether | |
| Labels: | ||
| CAS: | 32669-06-0 | |
| InChi Code: | InChI=1S/C15H15ClO/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11-12H2 |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| -0.069174539 |
experimental value |
| 0.6319 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |