| CAS Number | 2794-71-0 |
| Catalog Number | AG01A5SB(AGN-PC-0O8JCT) |
| Chemical Name | 3,3,3-Trifluoro-2-methylpropan-1-amine hydrochloride |
| IUPAC Name | 3,3,3-trifluoro-2-methylpropan-1-amine;hydrochloride |
| InChI | InChI=1S/C4H8F3N.ClH/c1-3(2-8)4(5,6)7;/h3H,2,8H2,1H3;1H |
| InChI Key | QMROEFSSWWRDLS-UHFFFAOYSA-N |
| MDL Number | MFCD26407559 |
| Molecular Formula | C4H9ClF3N |
| Molecular Weight | 163.5692 |
| SMILES | Cl.CC(C(F)(F)F)CN |
| Synonyms | 3,3,3-Trifluoro-2-methylpropan-1-amine hydrochloride,
2794-71-0,
SCHEMBL8791761,
MFCD26407559,
AKOS024462744,
MCULE-5553040358,
2-(Trifluoromethyl)propylamine hydrochloride,
F8887-7092,
Z1744689501,
|
| Complexity | 68.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.568g/mol |
| Monoisotopic Mass | 163.038g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number