| CAS Number | 1354953-66-4 |
| Catalog Number | AG019RUJ(AGN-PC-0WOV1F) |
| Chemical Name | N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide hydrochloride |
| IUPAC Name | N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide;hydrochloride |
| InChI | InChI=1S/C8H13F3N2O.ClH/c9-8(10,11)5-13-7(14)6-2-1-3-12-4-6;/h6,12H,1-5H2,(H,13,14);1H |
| InChI Key | DCJDWPBSAGEAHZ-UHFFFAOYSA-N |
| MDL Number | MFCD20441678 |
| Molecular Formula | C8H14ClF3N2O |
| Molecular Weight | 246.6578 |
| SMILES | Cl.FC(CNC(C1CNCCC1)=O)(F)F |
| Synonyms | N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide hydrochloride,
1354953-66-4,
AKOS008105000,
NE43716,
EN300-90536,
A1-06904,
Z1270446308,
|
| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 246.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.658g/mol |
| Monoisotopic Mass | 246.075g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number