2-Fluoropropionic acid

C₃H₅FO₂CAS 6087-13-492.07 g/mol

Open in Covalent MOL file

Alkyl halide Carboxylic acid

Properties

Molecular formula: C₃H₅FO₂
Molar mass: 92.07 g/mol
Exact mass: 92.0274 Da
logP: 0.43Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed97.8% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, P501

Identifiers

CAS number

6087-13-4

SMILES

CC(C(=O)O)F

InChIKey

ZVZPFTCEXIGSHM-UHFFFAOYSA-N

InChI

InChI=1S/C3H5FO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6)

Weigh it out

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

Work with 2-Fluoropropionic 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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Difluoroacetic acid381-73-750 % similar Methylmalonic acid516-05-250 % similar Isobutyric acid79-31-250 % similar 2-Amino-3-fluorobutanoic acid50885-01-346 % similar D-Lactic acid10326-41-746 % similar Poly[(+)-lactic acid]106989-11-146 % similar Polylactic acid26100-51-646 % similar Lactic acid50-21-546 % similar

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

Same formula

Methyl fluoroacetate453-18-9 3-Fluoropropanoic acid461-56-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook