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: | 1813 | |
|---|---|---|
| Name: | 4,5-dichlorobenzene-1,2-diol | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 4,5-Dichlorocatechol | |
| Labels: | ||
| CAS: | 3428-24-8 | |
| InChi Code: | InChI=1S/C6H4Cl2O2/c7-3-1-5(9)6(10)2-4(3)8/h1-2,9-10H |
Properties
M1.pLC50: 96-h Fathead minnow toxicity as log(1/LC50) [-log(mol/L)]
| Value | Source or prediction |
|---|---|
| 5.3 |
experimental value |
| 4.4727 |
Tab2.Model_1: P. promelas LC50 (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7022207 | US EPA CompTox Dashboard |