chempirical

1-Trifluoroacetyl piperidine

C7H10F3NOCAS 340-07-8181.16 g/mol

Open in Covalent MOL file
ONFFF
Alkyl halideAmide

Properties

Molecular formula
C7H10F3NO
Molar mass
181.16 g/mol
Exact mass
181.0714 Da
Boiling point
90 °C (at 11 Torr)
logP
1.56Crippen estimate
Polar surface area
20.3 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
340-07-8
SMILES
O=C(N1CCCCC1)C(F)(F)F
InChIKey
BCJUMGSHTLYECD-UHFFFAOYSA-N
InChI
InChI=1S/C7H10F3NO/c8-7(9,10)6(12)11-4-2-1-3-5-11/h1-5H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • 2,2,2-Trifluoro-1-(1-piperidinyl)ethanone
  • Ethanone, 2,2,2-trifluoro-1-(1-piperidinyl)-
  • Piperidine, 1-(trifluoroacetyl)-
  • 1-(Trifluoroacetyl)piperidine
  • N-(Trifluoroacetyl)piperidine
  • 2,2,2-Trifluoro-1-(piperidin-1-yl)ethanone
  • 2,2,2-Trifluoro-1-(piperidin-1-yl)ethan-1-one

Work with 1-Trifluoroacetyl piperidine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N,N-Diethyl-2,2,2-trifluoroacetamide360-92-956 % similar 2,2,2-Trifluoro-N,N-dimethylacetamide1547-87-144 % similar N-Methylbis(trifluoroacetyl)imide685-27-844 % similar 2,3,4,5-Tetrahydro-3-(trifluoroacetyl)-1,5-methano-1H-3-benzazepine230615-51-741 % similar 1,1'-Carbonyldipyrrolidine81759-25-340 % similar 1-Acetylpiperidine618-42-839 % similar 2-Chloro-1-(1-piperidinyl)ethanone1440-60-438 % similar 2,2,2-Trifluoro-N-methoxy-N-methylacetamide104863-67-438 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook