Fluoranil

C6F4O2CAS 527-21-9180.06 g/mol

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AlkeneKetoneVinyl halide

Properties

Molecular formula
C6F4O2
Molar mass
180.06 g/mol
Exact mass
179.9834 Da
Melting point
184 °C
logP
1.44Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
527-21-9
SMILES
O=C1C(F)=C(F)C(=O)C(F)=C1F
InChIKey
JKLYZOGJWVAIQS-UHFFFAOYSA-N
InChI
InChI=1S/C6F4O2/c7-1-2(8)6(12)4(10)3(9)5(1)11

Weigh it out

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

Names and synonyms

14 names · show all
  • 2,5-Cyclohexadiene-1,4-dione, 2,3,5,6-tetrafluoro-
  • p-Benzoquinone, 2,3,5,6-tetrafluoro-
  • p-Benzoquinone, tetrafluoro-
  • 2,3,5,6-Tetrafluoro-2,5-cyclohexadiene-1,4-dione
  • Tetrafluoro-p-benzoquinone
  • Fluoroanil
  • p-Fluoranil
  • 2,3,5,6-Tetrafluoro-p-benzoquinone
  • Tetrafluoro-1,4-benzoquinone
  • Perfluoro-p-benzoquinone
  • 2,3,5,6-Tetrafluoro-1,4-benzoquinone
  • Tetrafluorobenzoquinone
  • NSC 264881
  • Tetrafluoro-p-quinone

Work with Fluoranil

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

Cyclohexanehexone527-31-145 % similar Carbonyl fluoride353-50-433 % similar Hexafluorobutadiene685-63-233 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook