| CAS Number | 1432679-31-6 |
| Catalog Number | AG01A4RR(AGN-PC-0WO0B3) |
| Chemical Name | 2-[5-(Trifluoromethyl)thiophen-2-yl]ethan-1-amine hydrochloride |
| IUPAC Name | 2-[5-(trifluoromethyl)thiophen-2-yl]ethanamine;hydrochloride |
| InChI | InChI=1S/C7H8F3NS.ClH/c8-7(9,10)6-2-1-5(12-6)3-4-11;/h1-2H,3-4,11H2;1H |
| InChI Key | SKQJMFOMRXRZBO-UHFFFAOYSA-N |
| MDL Number | MFCD23701980 |
| Molecular Formula | C7H9ClF3NS |
| Molecular Weight | 231.6663 |
| SMILES | C1=C(SC(=C1)C(F)(F)F)CCN.Cl |
| Synonyms | 2-[5-(trifluoromethyl)thiophen-2-yl]ethan-1-amine hydrochloride,
1432679-31-6,
AKOS026726165,
NE46518,
EN300-126613,
|
| Complexity | 148 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.661g/mol |
| Monoisotopic Mass | 231.01g/mol |
| Rotatable Bond Count | 2 |
| 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