Molecule record

1,2,3,4,5,6-hexachlorocyclohexane

C6H6Cl6

290.83 g/mol

Loading structure

Molecular properties

Formula
C6H6Cl6
Molar mass
290.83 g·mol−1
Exact mass
287.8601 Da
1
PubChem CID
727

Functional groups

Alkane / alkyl carbon
Alkyl halide

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 27154-44-5
  • 58-89-9
  • BETA-HEXACHLOROCYCLOHEXANE
  • Benzene hexachloride
  • CHEBI:24536
  • DTXCID30687
  • DTXSID7020687
  • DTXSID80891695
Show all 24 synonyms
  • Epsilon hexachlorocyclohexane
  • Eta hexachlorocyclohexane
  • Hexachlorane
  • Hexachloride, Benzene
  • Hexachlorocyclohexane
  • Hexachlorzyklohexan
  • Kwell
  • RefChem:66976
  • Zeta hexachlorocyclohexane
  • alpha-HCH
  • beta-BHC
  • beta-HCH
  • delta-BHC
  • gamma-BHC
  • gamma-HCH
  • lindane

Structure identifiers

Canonical SMILES
ClC1C(Cl)C(Cl)C(Cl)C(Cl)C1Cl
Isomeric SMILES
C1(C(C(C(C(C1Cl)Cl)Cl)Cl)Cl)Cl
InChI
InChI=1S/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H
InChIKey
JLYXXMFPNIAWKQ-UHFFFAOYSA-N
PubChem CID
727

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 1,2,3,4,5,6-hexachlorocyclohexane; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1,2,3,4,5,6-hexachlorocyclohexane; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record