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: | 1910 | |
|---|---|---|
| Name: | 2,2,2-trifluoroethan-1-amine | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: trifluoroethylamine | |
| Labels: | ||
| CAS: | 753-90-2 | |
| InChi Code: | InChI=1S/C2H4F3N/c3-2(4,5)1-6/h1,6H2 |
Properties
M12.pLC50: Acute inhalation toxicity in mice as log(1/LC50) [-log(mmol/m^3)] i
| Value | Source or prediction |
|---|---|
| 4.376 |
experimental value |
| 4.0967 |
Tab2.Model_12: PFC inal. mouse LC50 (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID6061070 | US EPA CompTox Dashboard |