| CAS Number | 1203685-55-5 |
| Catalog Number | AG00HFFV(AGN-PC-0WOFS2) |
| Chemical Name | Methyl 5-phenylpiperidine-3-carboxylate hydrochloride |
| IUPAC Name | methyl 5-phenylpiperidine-3-carboxylate;hydrochloride |
| InChI | InChI=1S/C13H17NO2.ClH/c1-16-13(15)12-7-11(8-14-9-12)10-5-3-2-4-6-10;/h2-6,11-12,14H,7-9H2,1H3;1H |
| InChI Key | CQJXDJVQUTWQOJ-UHFFFAOYSA-N |
| MDL Number | MFCD08751788 |
| Molecular Formula | C13H18ClNO2 |
| Molecular Weight | 255.7405 |
| SMILES | Cl.COC(C1CC(C2=CC=CC=C2)CNC1)=O |
| Synonyms | methyl 5-phenylpiperidine-3-carboxylate hydrochloride,
1203685-55-5,
methyl5-phenylpiperidine-3-carboxylatehydrochloride,
AKOS027253928,
OR53148,
SB15521,
CS-0056549,
|
| Complexity | 236 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.742g/mol |
| Monoisotopic Mass | 255.103g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number