| CAS Number | 1432681-27-0 |
| Catalog Number | AG01A4EN(AGN-PC-0WOC23) |
| Chemical Name | (1S)-1-(5-Chlorothiophen-2-yl)ethan-1-amine hydrochloride |
| IUPAC Name | (1S)-1-(5-chlorothiophen-2-yl)ethanamine;hydrochloride |
| InChI | InChI=1S/C6H8ClNS.ClH/c1-4(8)5-2-3-6(7)9-5;/h2-4H,8H2,1H3;1H/t4-;/m0./s1 |
| InChI Key | QBNZSVFQOHBMAA-WCCKRBBISA-N |
| MDL Number | MFCD12760100 |
| Molecular Formula | C6H9Cl2NS |
| Molecular Weight | 198.1134 |
| SMILES | Cl.ClC1=CC=C(S1)[C@H](C)N |
| Synonyms | (1S)-1-(5-chlorothiophen-2-yl)ethan-1-amine hydrochloride,
1432681-27-0,
AKOS026729957,
MCULE-4001760632,
NE31395,
Z1583815700,
|
| Complexity | 99.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.983g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.105g/mol |
| Monoisotopic Mass | 196.983g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number