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Record Information
HMDB Statusdetected
Creation Date2024-02-21 00:31:15 UTC
Update Date2025-03-21 18:41:56 UTC
HMDB IDHMDB0250111
Metabolite Identification
DeepMet IDDMID00136897
NameChlorodifluoroacetic acid
Frequency18.3
Structure
Chemical FormulaC2HClF2O2
Molecular Mass129.9633
SMILESO=C(O)C(F)(F)Cl
InChI KeyOAWAZQITIZDJRB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass alpha-halocarboxylic acids and derivatives
Direct Parent alpha-halocarboxylic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl chlorides
  • alkyl fluorides
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organochlorides
  • organofluorides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alkyl fluoride
  • organofluoride
  • alkyl chloride
  • organochloride
  • alpha-halocarboxylic acid
  • organohalogen compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound