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: | 1393 | |
|---|---|---|
| Name: | 1,2,3,7,8,9-hexachlorooxanthrene | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 1.2.3.7.8.9-Hexachlorodibenzo-p-dioxin | |
| Labels: | ||
| CAS: | 19408-74-3 | |
| InChi Code: | InChI=1S/C12H2Cl6O2/c13-3-1-5-11(9(17)7(3)15)20-12-6(19-5)2-4(14)8(16)10(12)18/h1-2H |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 1.300825461 |
experimental value |
| 1.974 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID6023781 | US EPA CompTox Dashboard |