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: | 1968 | |
|---|---|---|
| Name: | 1,2,2-trichloro-1,1,3,3,3-pentafluoropropane | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 1,2,2-Trichloropentafluoropropane | |
| Labels: | ||
| CAS: | 1599-41-3 | |
| InChi Code: | InChI=1S/C3Cl3F5/c4-1(5,2(6,7)8)3(9,10)11 |
Properties
M14.pLD50: Acute oral toxicity in rat as log(1/LD50) [-log(mmol/kg)] i
| Value | Source or prediction |
|---|---|
| 0.984 |
experimental value |
| 1.9342 |
Tab2.Model_14: PFC oral rat LD50 (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID50166766 | US EPA CompTox Dashboard |