Substance
  • Substance Name: 4-hexylbenzoic acid
  • Formula: C13H18O2
  • Molecular Weight: 206.28 g/mol
  • Identifiers:
    • inchi: InChI=1S/C13H18O2/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h7-10H,2-6H2,1H3,(H,14,15)
    • inchikey: CPEPWESLFZVUEP-UHFFFAOYSA-N
    • casrn: 21643-38-9
    • csmiles: CCCCCCC1=CC=C(C=C1)C(=O)O
    • ismiles: CCCCCCC1=CC=C(C=C1)C(=O)O
    • pubchemId: 30725
    • iupacname: 4-hexylbenzoic acid
    • wikidataId: Q72482296
    • dsstoxcmpId: DTXCID8036526
    • ecnumber: 244-490-6
4-hexylbenzoic acid
Systems and Datasets