Substance
  • Substance Name: 2,4-pentanedione
  • Formula: C5H8O2
  • Molecular Weight: 100.12 g/mol
  • Identifiers:
    • casrn: 123-54-6
    • pubchemId: 31261
    • iupacname: pentane-2,4-dione
    • inchi: InChI=1S/C5H8O2/c1-4(6)3-5(2)7/h3H2,1-2H3
    • inchikey: YRKCREAYFQTBPV-UHFFFAOYSA-N
    • csmiles: CC(=O)CC(=O)C
    • ismiles: CC(=O)CC(=O)C
    • wikidataId: Q413447
    • chemspiderId: 29001
    • dsstoxcmpId: DTXCID601979
    • chemblId: CHEMBL191625
    • ecnumber: 204-634-0
2,4-pentanedione
Systems and Datasets