Substance
  • Substance Name: caffeic acid
  • Formula: C9H8O4
  • Molecular Weight: 180.16 g/mol
  • Identifiers:
    • inchi: InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)
    • inchikey: QAIPRVGONGVQAS-UHFFFAOYSA-N
    • casrn: 331-39-5
    • csmiles: C1=CC(=C(C=C1C=CC(=O)O)O)O
    • ismiles: C1=CC(=C(C=C1C=CC(=O)O)O)O
    • pubchemId: 2518
    • iupacname: 3-(3,4-dihydroxyphenyl)prop-2-enoic acid
    • wikidataId: Q56231106
    • dsstoxcmpId: DTXCID10231
caffeic acid
Systems and Datasets