| CAS Number | 78854-27-0 |
| Catalog Number | AG00G8J2(AGN-PC-0WCL8H) |
| Chemical Name | Cis-4-Mercapto-L-proline hydrochloride |
| IUPAC Name | (2S,4S)-4-sulfanylpyrrolidine-2-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C5H9NO2S.ClH/c7-5(8)4-1-3(9)2-6-4;/h3-4,6,9H,1-2H2,(H,7,8);1H/t3-,4-;/m0./s1 |
| InChI Key | OBUGHYLMLADJFK-MMALYQPHSA-N |
| MDL Number | MFCD11557234 |
| Molecular Formula | C5H10ClNO2S |
| Molecular Weight | 183.6564 |
| SMILES | Cl.S[C@H]1C[C@H](NC1)C(=O)O |
| Synonyms | 78854-27-0,
Cis-4-Mercapto-L-proline hydrochloride,
(4S)-4-mercapto-L-proline hydrochloride,
(2S,4S)-4-sulfanylpyrrolidine-2-carboxylic acid hydrochloride,
SCHEMBL5698094,
OBUGHYLMLADJFK-MMALYQPHSA-N,
KS-000008UW,
L-Proline,4-mercapto-,hydrochloride(1,
CS-0053409,
Q-2135,
A1-03716,
cis 4-Mercapto-pyrrolidine-2-carboxylic acid hydrochloride,
(4S)-4-MERCAPTO-L-PROLINE CHLORIDE,
171189-35-8,
|
| Complexity | 128 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.012g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.65g/mol |
| Monoisotopic Mass | 183.012g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number