Trifluoroacetyl chloride
Properties
- Molecular formula
- C2ClF3O
- Molar mass
- 132.47 g/mol
- Exact mass
- 131.9590 Da
- Melting point
- 146 °C
- Boiling point
- −27 °C
- logP
- 1.31Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 0
Identifiers
CAS number
354-32-5SMILES
O=C(Cl)C(F)(F)FInChIKey
PNQBEPDZQUOCNY-UHFFFAOYSA-NInChI
InChI=1S/C2ClF3O/c3-1(7)2(4,5)6Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Acetyl chloride, 2,2,2-trifluoro-
- Acetyl chloride, trifluoro-
- 2,2,2-Trifluoroacetyl chloride
- Perfluoroacetyl chloride
Work with Trifluoroacetyl chloride
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-Tetrafluorobutanedioyl dichloride356-15-058 % similar
2-Chloro-2,2-difluoroacetyl chloride354-24-555 % similar
Bromodifluoroacetyl chloride3832-48-250 % similar
2,2,3,3,4,4-Hexafluoropentanedioyl dichloride678-77-350 % similar
Trichloroacetyl chloride76-02-845 % similar
Heptafluorobutyryl chloride375-16-644 % similar
Pivaloyl chloride3282-30-243 % similar
2,3-Dichloro-1,1,1,4,4,4-hexafluoro-2-butene303-04-842 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds