Fluoroacetic acid
Properties
- Molecular formula
- C2H3FO2
- Molar mass
- 78.04 g/mol
- Exact mass
- 78.0117 Da
- Density
- 1.3693 g/mL (at 36 °C)
- Melting point
- 35.2 °C
- Boiling point
- 165 °C
- pKa
- 2.59
- Water solubility
- miscible (25 °C)
- logP
- 0.04Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H300 Fatal if swallowedAcute toxicity, oral
- H400 Very toxic to aquatic lifeHazardous to the aquatic environment, acute hazard
Harmonised EU classification (CLP Annex VI, index 607-081-00-7), via PubChem.
Precautionary statements
P264, P270, P273, P301+P316, P321, P330, P391, P405, P501
Identifiers
CAS number
144-49-0SMILES
O=C(O)CFInChIKey
QEWYKACRFQMRMB-UHFFFAOYSA-NInChI
InChI=1S/C2H3FO2/c3-1-2(4)5/h1H2,(H,4,5)Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
9 names
- Acetic acid, 2-fluoro-
- Acetic acid, fluoro-
- 2-Fluoroacetic acid
- Cymonic acid
- Fluoroethanoic acid
- Gifblaar poison
- HFA
- Monofluoroacetic acid
- α-Fluoroacetic acid
Work with Fluoroacetic acid
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
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
3-Fluoropropanoic acid461-56-352 % similar
Succinic acid110-15-650 % similar
Malonic acid141-82-250 % similar
4-Fluorobutanoic acid462-23-748 % similar
3,3,3-Trifluoropropionic acid2516-99-645 % similar
Glutaric acid110-94-145 % similar
Adipic acid124-04-945 % similar
Polyglycolide26124-68-545 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.