chempirical

Hexachlorocyclopentadiene

C5Cl6CAS 77-47-4272.75 g/mol

Open in Covalent MOL file
ClClClClClCl
AlkeneAlkyl halideVinyl halide

Properties

Molecular formula
C5Cl6
Molar mass
272.75 g/mol
Exact mass
269.8131 Da
Density
1.7019 g/mL (at 25 °C)
Melting point
−9 °C
Boiling point
239 °C
logP
4.55Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
77-47-4
SMILES
ClC1=C(Cl)C(Cl)(Cl)C(Cl)=C1Cl
InChIKey
VUNCWTMEJYMOOR-UHFFFAOYSA-N
InChI
InChI=1S/C5Cl6/c6-1-2(7)4(9)5(10,11)3(1)8

Weigh it out

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

Names and synonyms

10 names
  • 1,3-Cyclopentadiene, 1,2,3,4,5,5-hexachloro-
  • Cyclopentadiene, hexachloro-
  • 1,2,3,4,5,5-Hexachloro-1,3-cyclopentadiene
  • C 56
  • HRS 1655
  • Graphlox
  • Perchlorocyclopentadiene
  • Hexachloro-1,3-cyclopentadiene
  • NSC 9235
  • 1,2,3,4,5,5-Hexachlorocyclopentadiene

Work with Hexachlorocyclopentadiene

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

Hexachloropropene1888-71-733 % similar 2,3-Dichloro-1,1,1,4,4,4-hexafluoro-2-butene303-04-830 % similar

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

Elsewhere

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