| CAS Number | 1124199-60-5 |
| Catalog Number | AG00HCE3(AGN-PC-0WCKK8) |
| Chemical Name | 3-(Trifluoromethyl)piperidine hydrochloride |
| IUPAC Name | 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 |
| InChI Key | HMFJYLYZLJHSIF-UHFFFAOYSA-N |
| MDL Number | MFCD04971985 |
| Molecular Formula | C6H11ClF3N |
| Molecular Weight | 189.6064 |
| SMILES | FC(C1CCCNC1)(F)F.Cl |
| Synonyms | 3-(TRIFLUOROMETHYL)PIPERIDINE HYDROCHLORIDE,
1124199-60-5,
3-(Trifluoromethyl)piperidine HCl,
(S)-3-(Trifluoromethyl)piperidine hydrochloride,
SCHEMBL3249707,
HMFJYLYZLJHSIF-UHFFFAOYSA-N,
3-(Trifluoromethyl)piperidine, HCl,
MFCD04971985,
AKOS025403279,
PB34080,
AS-50468,
(+/-)-3-trifluoromethylpiperidine hydrochloride,
F1907-2450,
C6H11ClF3N,
MFCD02183561,
(R)-3-(Trifluoromethyl)piperidine hydrochloride,
737760-98-4,
1419075-99-2,
768-31-0,
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| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| 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 | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number