| CAS Number | 1417794-45-6 |
| Catalog Number | AG019G23(AGN-PC-0WOU5U) |
| Chemical Name | 3-(trifluoroMethyl)piperidin-3-ol hydrochloride |
| IUPAC Name | 3-(trifluoromethyl)piperidin-3-ol;hydrochloride |
| InChI | InChI=1S/C6H10F3NO.ClH/c7-6(8,9)5(11)2-1-3-10-4-5;/h10-11H,1-4H2;1H |
| InChI Key | PPGUTDFYLNZYCH-UHFFFAOYSA-N |
| MDL Number | MFCD19686797 |
| Molecular Formula | C6H11ClF3NO |
| Molecular Weight | 205.6058 |
| SMILES | OC1(CCCNC1)C(F)(F)F.Cl |
| Synonyms | 3-(trifluoromethyl)piperidin-3-ol hydrochloride,
1417794-45-6,
MFCD19686797,
AKOS026743604,
PC430140,
3-(TRIFLUOROMETHYL)PIPERIDIN-3-OLHYDROCHLORIDE,
3-(trifluoromethyl)piperidin-3-olhydrochloride-T28077,
F8888-3429,
Z2753056772,
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| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.605g/mol |
| Monoisotopic Mass | 205.048g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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