| CAS Number | 1009376-67-3 |
| Catalog Number | AG00038L(AGN-PC-0WNH89) |
| Chemical Name | Methyl (3r,4r)-rel-4-methylpiperidine-3-carboxylate hydrochloride |
| IUPAC Name | methyl (3R,4R)-4-methylpiperidine-3-carboxylate;hydrochloride |
| InChI | InChI=1S/C8H15NO2.ClH/c1-6-3-4-9-5-7(6)8(10)11-2;/h6-7,9H,3-5H2,1-2H3;1H/t6-,7+;/m1./s1 |
| InChI Key | QATUSYOQNXADOL-HHQFNNIRSA-N |
| MDL Number | MFCD30531380 |
| Molecular Formula | C8H16ClNO2 |
| Molecular Weight | 193.6711 |
| SMILES | Cl.C[C@H]1[C@H](CNCC1)C(=O)OC |
| Synonyms | 1009376-67-3,
methyl (3R,4R)-rel-4-methylpiperidine-3-carboxylate hydrochloride,
Methyl (3R,4R)-rel-4-methylpiperidine-3-carboxylate HCl,
(3R,4R)-Methyl 4-methylpiperidine-3-carboxylate hydrochloride,
MFCD30531380,
AKOS030630916,
SB23210,
AS-53584,
CS-0049281,
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| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.671g/mol |
| Monoisotopic Mass | 193.087g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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