Substance
  • Substance Name: benzoic acid, hexyl ester
  • Formula: C13H18O2
  • Molecular Weight: 206.28 g/mol
  • Identifiers:
    • casrn: 6789-88-4
    • pubchemId: 23235
    • iupacname: hexyl benzoate
    • inchi: InChI=1S/C13H18O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3
    • inchikey: UUGLJVMIFJNVFH-UHFFFAOYSA-N
    • csmiles: CCCCCCOC(=O)C1=CC=CC=C1
    • ismiles: CCCCCCOC(=O)C1=CC=CC=C1
    • wikidataId: Q27291980
    • chemspiderId: 21738
    • dsstoxcmpId: DTXCID505403
    • chemblId: CHEMBL2260717
    • ecnumber: 229-856-5
benzoic acid, hexyl ester
Systems and Datasets