chempirical

Fluoroacetonitrile

C2H2FNCAS 503-20-859.04 g/mol

Open in Covalent MOL file
NF
Alkyl halideNitrile

Properties

Molecular formula
C2H2FN
Molar mass
59.04 g/mol
Exact mass
59.0171 Da
Density
1.073 g/mL (at 16 °C)
Boiling point
81.8–82 °C
logP
0.48Crippen estimate
Polar surface area
23.8 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
503-20-8
SMILES
N#CCF
InChIKey
GNFVFPBRMLIKIM-UHFFFAOYSA-N
InChI
InChI=1S/C2H2FN/c3-1-2-4/h1H2

Weigh it out

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

Names and synonyms

4 names
  • Acetonitrile, fluoro-
  • Fluoromethyl cyanide
  • Monofluoroacetonitrile
  • 2-Fluoroacetonitrile

Work with Fluoroacetonitrile

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

Malononitrile109-77-340 % similar Succinonitrile110-61-240 % similar Adiponitrile111-69-335 % similar Allyl cyanide109-75-135 % similar 2-(Methyleneamino)acetonitrile109-82-035 % similar Propionitrile107-12-033 % similar Chloroacetonitrile107-14-233 % similar Glycolonitrile107-16-433 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook