Fluoroacetone
Properties
- Molecular formula
- C3H5FO
- Molar mass
- 76.07 g/mol
- Exact mass
- 76.0324 Da
- Density
- 1.0288 g/mL (at 20 °C)
- Boiling point
- 77 °C
- logP
- 0.54Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Identifiers
CAS number
430-51-3SMILES
CC(=O)CFInChIKey
MSWVMWGCNZQPIA-UHFFFAOYSA-NInChI
InChI=1S/C3H5FO/c1-3(5)2-4/h2H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
7 names
- 2-Propanone, 1-fluoro-
- 2-Propanone, fluoro-
- Monofluoroacetone
- 1-Fluoro-2-propanone
- Fluoromethyl methyl ketone
- α-Fluoroacetone
- NSC 21302
Work with Fluoroacetone
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
Hexane-2,5-dione110-13-450 % similar
Butanone78-93-345 % similar
Hydroxyacetone116-09-643 % similar
2-Pentanone107-87-941 % similar
Methyl isobutyl ketone108-10-139 % similar
1-(Methylthio)-2-propanone14109-72-939 % similar
Methoxyacetone5878-19-339 % similar
4,4-Dimethyl-2-pentanone590-50-139 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds