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: | 1747 | |
|---|---|---|
| Name: | 2,2-dichloroethanimidic acid | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 2,2-Dichloroacetamide | |
| Labels: | ||
| CAS: | 683-72-7 | |
| InChi Code: | InChI=1S/C2H3Cl2NO/c3-1(4)2(5)6/h1H,(H2,5,6) |
Properties
M1.pLC50: 96-h Fathead minnow toxicity as log(1/LC50) [-log(mol/L)]
| Value | Source or prediction |
|---|---|
| 2.73 |
experimental value |
| 2.4092 |
Tab2.Model_1: P. promelas LC50 (Training set) |