Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:56:51 UTC
Update Date2025-03-21 18:05:05 UTC
HMDB IDHMDB0243847
Metabolite Identification
DeepMet IDDMID00054684
Name1-Chloro-4-ethylbenzene
Frequency58.7
Structure
Chemical FormulaC8H9Cl
Molecular Mass140.0393
SMILESCCc1ccc(Cl)cc1
InChI KeyGPOFSFLJOIAMSA-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