| CAS Number | 1306607-04-4 |
| Catalog Number | AG01AIA1 |
| Chemical Name | N-(3-chloro-4-fluorophenyl)piperidine-4-carboxamide hydrochloride |
| IUPAC Name | N-(3-chloro-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride |
| InChI | InChI=1S/C12H14ClFN2O.ClH/c13-10-7-9(1-2-11(10)14)16-12(17)8-3-5-15-6-4-8;/h1-2,7-8,15H,3-6H2,(H,16,17);1H |
| InChI Key | AZJYSONABGKSQZ-UHFFFAOYSA-N |
| MDL Number | MFCD18838964 |
| Molecular Formula | C12H15Cl2FN2O |
| Molecular Weight | 293.1647 |
| SMILES | Cl.FC1=C(Cl)C=C(NC(C2CCNCC2)=O)C=C1 |
| Synonyms | N-(3-chloro-4-fluorophenyl)piperidine-4-carboxamide hydrochloride,
1306607-04-4,
AKOS025440371,
MCULE-1929863937,
NE23983,
EN300-77161,
Z1267881724,
|
| Complexity | 271 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 292.055g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 293.163g/mol |
| Monoisotopic Mass | 292.055g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number