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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:51:10 UTC
Update Date2025-03-21 18:02:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00041305
Frequency83.3
Structure
Chemical FormulaC6H4Cl2O2
Molecular Mass177.9588
SMILESOc1cc(O)c(Cl)cc1Cl
InChI KeyGRLQBYQELUWBIO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent dichlorobenzenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl chlorides
  • halophenols
  • hydrocarbon derivatives
  • o-chlorophenols
  • organochlorides
  • organooxygen compounds
  • p-chlorophenols
  • resorcinols
    • Substituents
  • aryl chloride
  • 2-chlorophenol
  • 4-chlorophenol
  • organochloride
  • 1-hydroxy-2-unsubstituted benzenoid
  • organohalogen compound
  • resorcinol
  • aryl halide
  • 1,3-dichlorobenzene
  • aromatic homomonocyclic compound
  • 2-halophenol
  • 4-halophenol
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • organooxygen compound