Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:35:27 UTC
Update Date2025-03-21 17:56:59 UTC
HMDB IDHMDB0244142
Metabolite Identification
DeepMet IDDMID00004897
Name1,2,4-Trichlorobenzene
Frequency1122.0
Structure
Chemical FormulaC6H3Cl3
Molecular Mass179.93
SMILESClc1ccc(Cl)c(Cl)c1
InChI KeyPBKONEOXTCPAFI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent chlorobenzenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl chlorides
  • hydrocarbon derivatives
  • organochlorides
  • Substituents
  • aryl chloride
  • chlorobenzene
  • aromatic homomonocyclic compound
  • organochloride
  • hydrocarbon derivative
  • organohalogen compound
  • aryl halide