| CAS Number | 923171-84-0 |
| Catalog Number | AG019PPB |
| Chemical Name | 1-(2-chloroacetyl)-N-phenylpiperidine-4-carboxamide |
| IUPAC Name | 1-(2-chloroacetyl)-N-phenylpiperidine-4-carboxamide |
| InChI | InChI=1S/C14H17ClN2O2/c15-10-13(18)17-8-6-11(7-9-17)14(19)16-12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H,16,19) |
| InChI Key | MJKSKCQYZODZCW-UHFFFAOYSA-N |
| MDL Number | MFCD08444301 |
| Molecular Formula | C14H17ClN2O2 |
| Molecular Weight | 280.7500 |
| SMILES | ClCC(N1CCC(C(NC2=CC=CC=C2)=O)CC1)=O |
| Synonyms | 1-(2-chloroacetyl)-N-phenylpiperidine-4-carboxamide,
1-(chloroacetyl)-N-phenylpiperidine-4-carboxamide,
923171-84-0,
AC1Q3TE1,
CTK6H4976,
ZINC9596247,
AKOS030685904,
MCULE-3624151220,
NE26652,
EN300-24638,
|
| Complexity | 321 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 280.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.752g/mol |
| Monoisotopic Mass | 280.098g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number