Substance
  • Substance Name: 3-octanone
  • Formula: C8H16O
  • Molecular Weight: 128.21 g/mol
  • Identifiers:
    • casrn: 106-68-3
    • pubchemId: 246728
    • iupacname: octan-3-one
    • inchi: InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h3-7H2,1-2H3
    • inchikey: RHLVCLIPMVJYKS-UHFFFAOYSA-N
    • csmiles: CCCCCC(=O)CC
    • ismiles: CCCCCC(=O)CC
    • wikidataId: Q18349104
    • chemspiderId: 215929
    • dsstoxcmpId: DTXCID1021954
    • chemblId: CHEMBL2269087
    • ecnumber: 203-423-0
3-octanone
Systems and Datasets