| CAS Number | 1419075-99-2 |
| Catalog Number | AG00HW92(AGN-PC-0WCL3T) |
| Chemical Name | (3R)-3-(trifluoromethyl)piperidine hydrochloride |
| IUPAC Name | (3R)-3-(trifluoromethyl)piperidine;hydrochloride |
| InChI | InChI=1S/C6H10F3N.ClH/c7-6(8,9)5-2-1-3-10-4-5;/h5,10H,1-4H2;1H/t5-;/m1./s1 |
| InChI Key | HMFJYLYZLJHSIF-NUBCRITNSA-N |
| MDL Number | MFCD23106415 |
| Molecular Formula | C6H11ClF3N |
| Molecular Weight | 189.6064 |
| SMILES | Cl.FC([C@H]1CNCCC1)(F)F |
| Synonyms | 1419075-99-2,
(R)-3-(Trifluoromethyl)piperidine hydrochloride,
(R)-3-(Trifluoromethyl)piperidine HCl,
(3R)-3-(trifluoromethyl)piperidine hydrochloride,
MFCD23106415,
PB36912,
SB10811,
AS-51885,
CS-0055350,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.606g/mol |
| Monoisotopic Mass | 189.053g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number