chempirical

1,2,3,4,5-Pentafluoro-6-(2-propen-1-yl)benzene

C9H5F5CAS 1736-60-3208.13 g/mol

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AlkeneAryl halide

Properties

Molecular formula
C9H5F5
Molar mass
208.13 g/mol
Exact mass
208.0311 Da
Boiling point
150 °C
logP
3.11Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Identifiers

CAS number
1736-60-3
SMILES
C=CCc1c(F)c(F)c(F)c(F)c1F
InChIKey
YBDBTBVNQQBHGJ-UHFFFAOYSA-N
InChI
InChI=1S/C9H5F5/c1-2-3-4-5(10)7(12)9(14)8(13)6(4)11/h2H,1,3H2

Weigh it out

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

Names and synonyms

10 names
  • 3-Pentafluorophenyl-1-propene
  • 3-Pentafluorophenylpropene
  • NSC 88279
  • 1-Allyl-2,3,4,5,6-pentafluorobenzene
  • 1,2,3,4,5-Pentafluoro-6-prop-2-enylbenzene
  • Benzene, 1,2,3,4,5-pentafluoro-6-(2-propen-1-yl)-
  • Benzene, allylpentafluoro-
  • Benzene, pentafluoro-2-propenyl-
  • 3-(Perfluorophenyl)propene
  • Allylpentafluorobenzene

Work with 1,2,3,4,5-Pentafluoro-6-(2-propen-1-yl)benzene

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

Pentafluorobenzyl alcohol440-60-838 % similar Pentafluorostyrene653-34-938 % similar 2,3,4,5,6-Pentafluorobenzyl chloride653-35-038 % similar Chavicol501-92-834 % similar 1,4-Bis(chloromethyl)tetrafluorobenzene131803-37-733 % similar Phenylpropene300-57-233 % similar Hexafluorobenzene392-56-333 % similar 2,3,4,5,6-Pentafluorobenzeneacetonitrile653-30-533 % similar

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

Elsewhere

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