Cas no 718597-60-5 (3-[(acetyloxy)methyl]-2-Furancarboxaldehyde)

3-[(acetyloxy)methyl]-2-Furancarboxaldehyde structure
718597-60-5 structure
Product Name:3-[(acetyloxy)methyl]-2-Furancarboxaldehyde
CAS No:718597-60-5
MF:C8H8O4
MW:168.146722793579
CID:1116536
PubChem ID:12111816
Update Time:2025-04-20

3-[(acetyloxy)methyl]-2-Furancarboxaldehyde Chemical and Physical Properties

Names and Identifiers

    • 3-[(acetyloxy)methyl]-2-Furancarboxaldehyde
    • (2-formylfuran-3-yl)methyl acetate
    • 2-Furancarboxaldehyde, 3-[(acetyloxy)methyl]-
    • DTXSID80477776
    • Acetoxymethylfurfurol
    • 718597-60-5
    • SCHEMBL132741
    • Inchi: 1S/C8H8O4/c1-6(10)12-5-7-2-3-11-8(7)4-9/h2-4H,5H2,1H3
    • InChI Key: SAZOAKOUMNDGRF-UHFFFAOYSA-N
    • SMILES: O1C=CC(=C1C=O)COC(C)=O

Computed Properties

  • Exact Mass: 168.04225873g/mol
  • Monoisotopic Mass: 168.04225873g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 4
  • Complexity: 178
  • 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: 0.5
  • Topological Polar Surface Area: 56.5?2
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