| CAS Number | 201481-62-1 |
| Catalog Number | AG01DKRL(AGN-PC-0O749W) |
| Chemical Name | (4S)-4-METHYL-L-PROLINE HCL |
| IUPAC Name | (2S,4S)-4-methylpyrrolidine-2-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C6H11NO2.ClH/c1-4-2-5(6(8)9)7-3-4;/h4-5,7H,2-3H2,1H3,(H,8,9);1H/t4-,5-;/m0./s1 |
| InChI Key | VLDINRBTKBFNDD-FHAQVOQBSA-N |
| MDL Number | MFCD17480334 |
| Molecular Formula | C6H12ClNO2 |
| Molecular Weight | 165.6180 |
| SMILES | O=C([C@H]1NC[C@@H](C)C1)O.[H]Cl |
| Synonyms | (4S)-4-METHYL-L-PROLINE HCL,
6734-41-4,
(2s,4s)-4-methyl-pyrrolidine-2-carboxylic acid,
201481-62-1,
Cis methyl-4 L-proline,
MFCD07784107,
(4S)-4-Methyl-L-proline hydrochloride,
AK170287,
AS-38035,
X-3696,
(2S,4S)-4-Methylpyrrolidine-2-carboxylic acid, HCl,
(2S,4S)-4-Methyl-pyrrolidine-2-carboxylic acid hydrochloride,
(2s,4s)-4-methylpyrrolidine-2-carboxylic acid,
(2S,4S)-4-Methylpyrrolidine-2-carboxylic acid monohydrochloride,
|
| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.617g/mol |
| Monoisotopic Mass | 165.056g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number