| CAS Number | 61786-58-1 |
| Catalog Number | AG01BIZS |
| Chemical Name | Ethyl 2-amino-3-(methylsulfanyl)propanoate hydrochloride |
| IUPAC Name | ethyl 2-amino-3-methylsulfanylpropanoate;hydrochloride |
| InChI | InChI=1S/C6H13NO2S.ClH/c1-3-9-6(8)5(7)4-10-2;/h5H,3-4,7H2,1-2H3;1H |
| InChI Key | VSVWQMIGAVLMCJ-UHFFFAOYSA-N |
| MDL Number | MFCD30751449 |
| Molecular Formula | C6H14ClNO2S |
| Molecular Weight | 199.6989 |
| NSC Number | 233871 |
| SMILES | Cl.NC(C(=O)OCC)CSC |
| Synonyms | 61786-58-1,
ETHYL 2-AMINO-3-(METHYLSULFANYL)PROPANOATE HYDROCHLORIDE,
DTXSID70638910,
NSC233871,
NSC-233871,
Ethyl S-methylcysteinate--hydrogen chloride (1/1),
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.693g/mol |
| Monoisotopic Mass | 199.043g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 77.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number