Difluoroacetic acid

C2H2F2O2CAS 381-73-796.03 g/mol

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Alkyl halideCarboxylic acid

Properties

Molecular formula
C2H2F2O2
Molar mass
96.03 g/mol
Exact mass
96.0023 Da
Density
1.53 g/mL (at 20 °C)
Melting point
−1 °C
Boiling point
133 °C
logP
0.34Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)

Aggregated from 52 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
381-73-7
SMILES
O=C(O)C(F)F
InChIKey
PBWZKZYHONABLN-UHFFFAOYSA-N
InChI
InChI=1S/C2H2F2O2/c3-1(4)2(5)6/h1H,(H,5,6)

Weigh it out

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Names and synonyms

3 names
  • Acetic acid, 2,2-difluoro-
  • Acetic acid, difluoro-
  • 2,2-Difluoroacetic acid

Work with Difluoroacetic 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

Similar compounds

1,2,3,4,5,6-Cyclohexanehexacarboxylic acid2216-84-450 % similar 2-Fluoropropionic acid6087-13-450 % similar (1S,2S)-2-Fluorocyclopropanecarboxylic acid105919-34-446 % similar (1R,2R)-2-Fluorocyclopropanecarboxylic acid127199-13-746 % similar (1S,2S)-2-Fluorocyclopropanecarboxylic acid127199-14-846 % similar trans-2-Fluoro-cyclopropanecarboxylic acid130340-04-446 % similar 2-Fluorocyclopropanecarboxylic acid156816-78-346 % similar DL-Tartaric acid133-37-945 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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