| CAS Number | 1820571-76-3 |
| Catalog Number | AG00J1K3(AGN-PC-0WRAMJ) |
| Chemical Name | 3-((2R,6S)-2,6-Dimethylpiperidin-1-yl)propanoic acid hydrochloride |
| IUPAC Name | 3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]propanoic acid;hydrochloride |
| InChI | InChI=1S/C10H19NO2.ClH/c1-8-4-3-5-9(2)11(8)7-6-10(12)13;/h8-9H,3-7H2,1-2H3,(H,12,13);1H/t8-,9+; |
| InChI Key | RNNDSXWFHOKNOX-UFIFRZAQSA-N |
| MDL Number | MFCD13186225 |
| Molecular Formula | C10H20ClNO2 |
| Molecular Weight | 221.7243 |
| SMILES | N1([C@H](C)CCC[C@@H]1C)CCC(O)=O.Cl |
| Synonyms | 3-[(2R,6S)-2,6-Dimethyl-1-piperidinyl]propanoic acid hydrochloride,
1820571-76-3,
3-((2R,6S)-2,6-Dimethylpiperidin-1-yl)propanoic acid hydrochloride,
MFCD13186225,
AKOS030529272,
AS-47618,
3-[(2r,6s)-2,6-dimethylpiperidin-1-yl]propanoic acid hcl,
3-[cis-2,6-dimethyl-1-piperidinyl]propanoic acid hydrochloride,
1820571-75-2,
1-(2-methylphenyl)-1-(2-thienyl)methanamine,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.118g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.725g/mol |
| Monoisotopic Mass | 221.118g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number