Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:56:46 UTC
Update Date2025-03-21 18:05:04 UTC
HMDB IDHMDB0245064
Metabolite Identification
DeepMet IDDMID00054513
Name2-Chloroaniline
Frequency59.0
Structure
Chemical FormulaC6H6ClN
Molecular Mass127.0189
SMILESNc1ccccc1Cl
InChI KeyAKCRQHGQIJBRMN-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
  • organopnictogen compounds
  • primary amines
  • Substituents
  • aryl chloride
  • chlorobenzene
  • organochloride
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine