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: | 1251 | |
|---|---|---|
| Name: | 2,4-dichloro-1-nitrobenzene | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 2.4-Dichloro-1-nitrobenzene The representation of nitro groups was fixed | |
| Labels: | ||
| CAS: | 611-06-3 | |
| InChi Code: | InChI=1S/C6H3Cl2NO2/c7-4-1-2-6(9(10)11)5(8)3-4/h1-3H |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 0.830825461 |
experimental value |
| 0.0659 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID3024998 | US EPA CompTox Dashboard |