Cas no 1438-90-0 (1-(2-Furanyl)-1, 2-butanedione)

1-(2-Furanyl)-1, 2-butanedione structure
1438-90-0 structure
Product Name:1-(2-Furanyl)-1, 2-butanedione
CAS No:1438-90-0
MF:C8H8O3
MW:152.147322654724
CID:2019206
PubChem ID:19776197
Update Time:2025-04-21

1-(2-Furanyl)-1, 2-butanedione Chemical and Physical Properties

Names and Identifiers

    • 1-(2-Furanyl)-1, 2-butanedione
    • 1-(furan-2-yl)butane-1,2-dione
    • 1-furan-2-yl-butane-1,2-dione
    • 2--furan
    • 2--butandion-1,2
    • Furyl-butan-1,2-dion
    • Aethyl-furyl-glyoxal
    • 1-(uran-2-yl)butane-1,2-dione
    • Ethyl 2-furanyl diketone
    • CHEBI:173648
    • 1438-90-0
    • DTXSID401306966
    • SCHEMBL9577885
    • 1-(2-Furanyl)-1,2-butanedione
    • Inchi: 1S/C8H8O3/c1-2-6(9)8(10)7-4-3-5-11-7/h3-5H,2H2,1H3
    • InChI Key: IWMXBRWYPMCNQM-UHFFFAOYSA-N
    • SMILES: O1C=CC=C1C(C(CC)=O)=O

Computed Properties

  • Exact Mass: 152.047344113Da
  • Monoisotopic Mass: 152.047344113Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 3
  • Complexity: 174
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.1
  • Topological Polar Surface Area: 47.3?2

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