| CAS Number | 914397-57-2 |
| Catalog Number | AG019Z9I(AGN-PC-0WO4IT) |
| Chemical Name | 1-(Trifluoromethane)sulfonylpiperidin-4-amine |
| IUPAC Name | 1-(trifluoromethylsulfonyl)piperidin-4-amine |
| InChI | InChI=1S/C6H11F3N2O2S/c7-6(8,9)14(12,13)11-3-1-5(10)2-4-11/h5H,1-4,10H2 |
| InChI Key | STUGVNMGOOCBQQ-UHFFFAOYSA-N |
| MDL Number | MFCD12137353 |
| Molecular Formula | C6H11F3N2O2S |
| Molecular Weight | 232.2239 |
| SMILES | NC1CCN(S(C(F)(F)F)(=O)=O)CC1 |
| Synonyms | 1-trifluoromethanesulfonylpiperidin-4-amine,
1-(trifluoromethane)sulfonylpiperidin-4-amine,
914397-57-2,
SCHEMBL693921,
STUGVNMGOOCBQQ-UHFFFAOYSA-N,
ZINC36753816,
AKOS009579920,
NE19242,
RP28011,
1-((trifluoromethyl)sulfonyl)piperidin-4-amine,
|
| Complexity | 287 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.221g/mol |
| Monoisotopic Mass | 232.049g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number