| CAS Number | 2095432-59-8 |
| Catalog Number | AG01EPDU(AGN-PC-3H46NG) |
| Chemical Name | 2-(4-(Benzyloxy)piperidin-1-yl)-N-methylethan-1-amine hydrochloride |
| IUPAC Name | N-methyl-2-(4-phenylmethoxypiperidin-1-yl)ethanamine;dihydrochloride |
| InChI | InChI=1S/C15H24N2O.2ClH/c1-16-9-12-17-10-7-15(8-11-17)18-13-14-5-3-2-4-6-14;;/h2-6,15-16H,7-13H2,1H3;2*1H |
| InChI Key | OPAWIOJQONUGQY-UHFFFAOYSA-N |
| Molecular Formula | C15H25ClN2O |
| Molecular Weight | 284.8248 |
| SMILES | Cl.O(CC=1C=CC=CC1)C2CCN(CCNC)CC2 |
| Synonyms | MS049 Dihydrochloride,
2095432-59-8,
MS049 (hydrochloride),
1502816-23-0(free base),
s8147,
N-methyl-4-(phenylmethoxy)-1-piperidineethanamine,dihydrochloride,
MS049,
1502816-23-0,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 320.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 321.286g/mol |
| Monoisotopic Mass | 320.142g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 24.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number