| CAS Number | 763110-36-7 |
| Catalog Number | AG01AOZK(AGN-PC-0U9H0B) |
| Chemical Name | 2-methyl-2-(piperidin-4-yl)propanoic acid hydrochloride |
| IUPAC Name | 2-methyl-2-piperidin-4-ylpropanoic acid;hydrochloride |
| InChI | InChI=1S/C9H17NO2.ClH/c1-9(2,8(11)12)7-3-5-10-6-4-7;/h7,10H,3-6H2,1-2H3,(H,11,12);1H |
| InChI Key | XFIMQCXXLAAEPX-UHFFFAOYSA-N |
| MDL Number | MFCD18837726 |
| Molecular Formula | C9H18ClNO2 |
| Molecular Weight | 207.6977 |
| SMILES | Cl.CC(C(O)=O)(C1CCNCC1)C |
| Synonyms | 2-methyl-2-(piperidin-4-yl)propanoic acid hydrochloride,
763110-36-7,
SCHEMBL6824935,
|
| Complexity | 171 |
| 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 | 2 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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