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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:35:13 UTC
Update Date2025-03-21 17:56:54 UTC
HMDB IDHMDB0037545
Metabolite Identification
DeepMet IDDMID00004369
Name2,4-Dibromo-1-(4-bromophenoxy)benzene
Frequency1289.2
Structure
Chemical FormulaC12H7Br3O
Molecular Mass403.8047
SMILESBrc1ccc(Oc2ccc(Br)cc2Br)cc1
InChI KeyUPNBETHEXPIWQX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylethers
Direct Parent bromodiphenyl ethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl bromides
  • bromobenzenes
  • diarylethers
  • hydrocarbon derivatives
  • organobromides
  • phenol ethers
  • phenoxy compounds
  • Substituents
  • diaryl ether
  • phenol ether
  • ether
  • bromodiphenyl ether
  • bromobenzene
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organobromide
  • hydrocarbon derivative
  • halobenzene
  • phenoxy compound
  • aryl bromide
  • organooxygen compound