| CAS Number | 1213191-77-5 |
| Catalog Number | AG009ZK5 |
| Chemical Name | (1S)-1-[5-(TRIFLUOROMETHYL)(2-PYRIDYL)]ETHYLAMINE |
| IUPAC Name | (1S)-1-[5-(trifluoromethyl)pyridin-2-yl]ethanamine |
| InChI | InChI=1S/C8H9F3N2/c1-5(12)7-3-2-6(4-13-7)8(9,10)11/h2-5H,12H2,1H3/t5-/m0/s1 |
| InChI Key | BOHFCACEJMSLFB-YFKPBYRVSA-N |
| MDL Number | MFCD09824133 |
| Molecular Formula | C8H9F3N2 |
| Molecular Weight | 190.1657 |
| SMILES | FC(C=1C=CC(=NC1)[C@H](C)N)(F)F |
| Synonyms | (1S)-1-[5-(TRIFLUOROMETHYL)(2-PYRIDYL)]ETHYLAMINE,
1213191-77-5,
MFCD09824133,
ZINC95755923,
AB52657,
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| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.169g/mol |
| Monoisotopic Mass | 190.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
Lot Number