| CAS Number | 1376313-97-1 |
| Catalog Number | AG019U4Y(AGN-PC-0WOSGX) |
| Chemical Name | 2-amino-2-(3-methylthiophen-2-yl)ethan-1-ol hydrochloride |
| IUPAC Name | 2-amino-2-(3-methylthiophen-2-yl)ethanol;hydrochloride |
| InChI | InChI=1S/C7H11NOS.ClH/c1-5-2-3-10-7(5)6(8)4-9;/h2-3,6,9H,4,8H2,1H3;1H |
| InChI Key | POQRQEJJWVNYRP-UHFFFAOYSA-N |
| MDL Number | MFCD22056350 |
| Molecular Formula | C7H12ClNOS |
| Molecular Weight | 193.6943 |
| SMILES | Cl.CC1=C(C(CO)N)SC=C1 |
| Synonyms | 2-amino-2-(3-methylthiophen-2-yl)ethan-1-ol hydrochloride,
1376313-97-1,
AKOS026742442,
MCULE-6853190681,
NE44109,
Z1342208344,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.689g/mol |
| Monoisotopic Mass | 193.033g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 74.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number