Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-21 02:35:34 UTC
Update Date2025-03-21 21:52:41 UTC
HMDB IDHMDB0060452
Metabolite Identification
DeepMet IDDMID00427674
NameChloroacetyl chloride
Frequency4.2
Structure
Chemical FormulaC2H2Cl2O
Molecular Mass111.9483
SMILESO=C(Cl)CCl
InChI KeyVGCXGMAHQTYDJK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classacyl halides
Subclass acyl chlorides
Direct Parent acyl chlorides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl chlorides
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • alkyl chloride
  • organochloride
  • organic oxide
  • organic oxygen compound
  • acyl chloride
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound