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: | 1406 | |
|---|---|---|
| Name: | 1,2,3,4,5-pentachloro-6-(1,2,2-trichloroethenyl)benzene | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Octachlorostyrene | |
| Labels: | ||
| CAS: | 29082-74-4 | |
| InChi Code: | InChI=1S/C8Cl8/c9-2-1(4(11)8(15)16)3(10)6(13)7(14)5(2)12 |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 2.040825461 |
experimental value |
| 2.0212 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |