| CAS Number | 1909315-99-6 |
| Catalog Number | AG01B21G |
| Chemical Name | 2-methyl-3-(piperidin-4-yl)propanoic acid hydrochloride |
| IUPAC Name | 2-methyl-3-piperidin-4-ylpropanoic acid;hydrochloride |
| InChI | InChI=1S/C9H17NO2.ClH/c1-7(9(11)12)6-8-2-4-10-5-3-8;/h7-8,10H,2-6H2,1H3,(H,11,12);1H |
| InChI Key | HOELICUFXIYBHA-UHFFFAOYSA-N |
| MDL Number | MFCD29907279 |
| Molecular Formula | C9H18ClNO2 |
| Molecular Weight | 207.6977 |
| SMILES | Cl.CC(C(O)=O)CC1CCNCC1 |
| Synonyms | 2-methyl-3-(piperidin-4-yl)propanoic acid hydrochloride,
1909315-99-6,
Z2471262519,
|
| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.698g/mol |
| Monoisotopic Mass | 207.103g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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