| CAS Number | 22189-91-9 |
| Catalog Number | AG01BDMN(AGN-PC-0WOU5W) |
| Chemical Name | 4-(Trifluoromethyl)bicyclo[2.2.2]octan-1-amine hydrochloride |
| IUPAC Name | 4-(trifluoromethyl)bicyclo[2.2.2]octan-1-amine;hydrochloride |
| InChI | InChI=1S/C9H14F3N.ClH/c10-9(11,12)7-1-4-8(13,5-2-7)6-3-7;/h1-6,13H2;1H |
| InChI Key | PTPQDAKVIDFFEU-UHFFFAOYSA-N |
| MDL Number | MFCD28023685 |
| Molecular Formula | C9H15ClF3N |
| Molecular Weight | 229.6703 |
| SMILES | Cl.NC12CCC(C(F)(F)F)(CC1)CC2 |
| Synonyms | 4-(trifluoromethyl)bicyclo[2.2.2]octan-1-amine hydrochloride,
22189-91-9,
MFCD28023685,
AKOS026425699,
Z1895582941,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.671g/mol |
| Monoisotopic Mass | 229.085g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number