| CAS Number | 1823395-48-7 |
| Catalog Number | AG00I19C(AGN-PC-0WR2FH) |
| Chemical Name | Benzyl 5-(Aminomethyl)-2-Methylpiperidine-1-Carboxylate Hydrochloride |
| IUPAC Name | benzyl 5-(aminomethyl)-2-methylpiperidine-1-carboxylate;hydrochloride |
| InChI | InChI=1S/C15H22N2O2.ClH/c1-12-7-8-14(9-16)10-17(12)15(18)19-11-13-5-3-2-4-6-13;/h2-6,12,14H,7-11,16H2,1H3;1H |
| InChI Key | JHTNUVDMZWBRDZ-UHFFFAOYSA-N |
| MDL Number | MFCD28119109 |
| Molecular Formula | C15H23ClN2O2 |
| Molecular Weight | 298.8083 |
| SMILES | Cl.CC1CCC(CN)CN1C(=O)OCc1ccccc1 |
| Synonyms | 1823395-48-7,
Benzyl 5-(aminomethyl)-2-methylpiperidine-1-carboxylate hydrochloride,
Benzyl 5-(aminomethyl)-2-methylpiperidine-1-carboxylate HCl,
MFCD28119109,
AKOS027256205,
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| Complexity | 290 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 298.145g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 298.811g/mol |
| Monoisotopic Mass | 298.145g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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