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: | 1932 | |
|---|---|---|
| Name: | tris(trifluoromethyl)-1,3,5-triazine | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 2,4,6-Tris(trifluoromethyl)-1,3,5-triazine | |
| Labels: | ||
| CAS: | 368-66-1 | |
| InChi Code: | InChI=1S/C6F9N3/c7-4(8,9)1-16-2(5(10,11)12)18-3(17-1)6(13,14)15 |
Properties
M13.pLC50: Acute inhalation toxicity in rat as log(1/LC50) [-log(mmol/m^3)] i
| Value | Source or prediction |
|---|---|
| 2.3088 |
experimental value |
| 2.8263 |
Tab2.Model_13: PFC inal. rat LC50 (Training set) |