chempirical

Trifluoroacetamide

C2H2F3NOCAS 354-38-1113.04 g/mol

Open in Covalent MOL file
NH2OFFF
Alkyl halide

Properties

Molecular formula
C2H2F3NO
Molar mass
113.04 g/mol
Exact mass
113.0088 Da
Melting point
72.5 °C
Boiling point
162.5 °C
logP
1.08Crippen estimate
Polar surface area
44.1 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
0

Identifiers

CAS number
354-38-1
SMILES
N=C(O)C(F)(F)F
InChIKey
NRKYWOKHZRQRJR-UHFFFAOYSA-N
InChI
InChI=1S/C2H2F3NO/c3-2(4,5)1(6)7/h(H2,6,7)

Weigh it out

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

Names and synonyms

3 names
  • Acetamide, 2,2,2-trifluoro-
  • 2,2,2-Trifluoroacetamide
  • NSC 9449

Work with Trifluoroacetamide

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,2,3,3-Tetrafluorobutanediamide377-37-758 % similar Chlorodifluoroacetamide354-28-950 % similar 2,2,3,3,3-Pentafluoropropanamide354-76-750 % similar Heptafluorobutyramide662-50-044 % similar Trichloroacetamide594-65-043 % similar 2,2-Dibromomalonamide73003-80-243 % similar Pivalamide754-10-943 % similar 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctanamide423-54-141 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook