| CAS Number | 1427380-30-0 |
| Catalog Number | AG01A3QS(AGN-PC-0WO0TL) |
| Chemical Name | 3-(trifluoromethyl)-5H,6H,7H,8H-imidazo[1,5-a]pyridine-7-carboxylic acid hydrochloride |
| IUPAC Name | 3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C9H9F3N2O2.ClH/c10-9(11,12)8-13-4-6-3-5(7(15)16)1-2-14(6)8;/h4-5H,1-3H2,(H,15,16);1H |
| InChI Key | WXXIJSQPSWKGLV-UHFFFAOYSA-N |
| MDL Number | MFCD23144070 |
| Molecular Formula | C9H10ClF3N2O2 |
| Molecular Weight | 270.6361 |
| SMILES | Cl.FC(C1=NC=C2N1CCC(C2)C(=O)O)(F)F |
| Synonyms | 3-(trifluoromethyl)-5H,6H,7H,8H-imidazo[1,5-a]pyridine-7-carboxylic acid hydrochloride,
1427380-30-0,
AKOS026726333,
NE62110,
|
| Complexity | 295 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.636g/mol |
| Monoisotopic Mass | 270.038g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number