| CAS Number | 1803587-02-1 |
| Catalog Number | AG01B982 |
| Chemical Name | 3-amino-6-(trifluoromethyl)-1,2-dihydropyridin-2-one hydrochloride |
| IUPAC Name | 3-amino-6-(trifluoromethyl)-1H-pyridin-2-one;hydrochloride |
| InChI | InChI=1S/C6H5F3N2O.ClH/c7-6(8,9)4-2-1-3(10)5(12)11-4;/h1-2H,10H2,(H,11,12);1H |
| InChI Key | LHIXVYQOMGIIEV-UHFFFAOYSA-N |
| MDL Number | MFCD28397394 |
| Molecular Formula | C6H6ClF3N2O |
| Molecular Weight | 214.5728 |
| SMILES | Cl.NC1C(=O)NC(C(F)(F)F)=CC=1 |
| Synonyms | 3-amino-6-(trifluoromethyl)-1,2-dihydropyridin-2-one hydrochloride,
1803587-02-1,
Z2044769202,
|
| Complexity | 277 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.012g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.572g/mol |
| Monoisotopic Mass | 214.012g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number