| CAS Number | 1311316-39-8 |
| Catalog Number | AG019Y0S |
| Chemical Name | 2,2,2-trifluoroethyl N-(1-acetylpiperidin-4-yl)carbamate |
| IUPAC Name | 2,2,2-trifluoroethyl N-(1-acetylpiperidin-4-yl)carbamate |
| InChI | InChI=1S/C10H15F3N2O3/c1-7(16)15-4-2-8(3-5-15)14-9(17)18-6-10(11,12)13/h8H,2-6H2,1H3,(H,14,17) |
| InChI Key | FSENGAVELWHZTF-UHFFFAOYSA-N |
| MDL Number | MFCD18483153 |
| Molecular Formula | C10H15F3N2O3 |
| Molecular Weight | 268.2329 |
| SMILES | CC(N1CCC(NC(OCC(F)(F)F)=O)CC1)=O |
| Synonyms | 2,2,2-trifluoroethyl N-(1-acetylpiperidin-4-yl)carbamate,
1311316-39-8,
ZINC62149297,
AKOS011047769,
MCULE-9248229465,
NE22554,
EN300-56578,
Z1238546133,
|
| Complexity | 312 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 268.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.236g/mol |
| Monoisotopic Mass | 268.103g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number