| CAS Number | 1629602-20-5 |
| Catalog Number | AG01BC8Z |
| Chemical Name | 4-benzyl-2-methylpiperidine hydrochloride |
| IUPAC Name | 4-benzyl-2-methylpiperidine;hydrochloride |
| InChI | InChI=1S/C13H19N.ClH/c1-11-9-13(7-8-14-11)10-12-5-3-2-4-6-12;/h2-6,11,13-14H,7-10H2,1H3;1H |
| InChI Key | LWHPJXAXXIUGBY-UHFFFAOYSA-N |
| MDL Number | MFCD28714751 |
| Molecular Formula | C13H20ClN |
| Molecular Weight | 225.7576 |
| SMILES | Cl.CC1NCCC(CC2=CC=CC=C2)C1 |
| Synonyms | 4-benzyl-2-methylpiperidine hydrochloride,
1629602-20-5,
SCHEMBL16112959,
LWHPJXAXXIUGBY-UHFFFAOYSA-N,
AKOS030757307,
Z2160914914,
|
| Complexity | 161 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.128g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.76g/mol |
| Monoisotopic Mass | 225.128g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number