| CAS Number | 74415-04-6 |
| Catalog Number | AG01A1O6(AGN-PC-0WO92W) |
| Chemical Name | N-(2,2,2-trifluoroethyl)pyridin-4-amine |
| IUPAC Name | N-(2,2,2-trifluoroethyl)pyridin-4-amine |
| InChI | InChI=1S/C7H7F3N2/c8-7(9,10)5-12-6-1-3-11-4-2-6/h1-4H,5H2,(H,11,12) |
| InChI Key | TUKVLFRRTNWHOJ-UHFFFAOYSA-N |
| MDL Number | MFCD11118880 |
| Molecular Formula | C7H7F3N2 |
| Molecular Weight | 176.1391 |
| SMILES | FC(CNC1=CC=NC=C1)(F)F |
| Synonyms | N-(2,2,2-trifluoroethyl)pyridin-4-amine,
74415-04-6,
SCHEMBL18235918,
ZINC20562594,
AKOS009228980,
MCULE-9511056727,
NE14932,
F9995-1882,
Z1483956643,
|
| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.142g/mol |
| Monoisotopic Mass | 176.056g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number