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: | 1955 | |
|---|---|---|
| Name: | 1,2,3,4,5-pentafluorobenzene | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: PENTAFLUOROBENZENE | |
| Labels: | ||
| CAS: | 363-72-4 | |
| InChi Code: | InChI=1S/C6HF5/c7-2-1-3(8)5(10)6(11)4(2)9/h1H |
Properties
M14.pLD50: Acute oral toxicity in rat as log(1/LD50) [-log(mmol/kg)] i
| Value | Source or prediction |
|---|---|
| 1.924 |
experimental value |
| 1.9342 |
Tab2.Model_14: PFC oral rat LD50 (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID8059893 | US EPA CompTox Dashboard |