Cas no 919530-89-5 (2-Furancarboxaldehyde, 4-[(acetyloxy)methyl]-)

2-Furancarboxaldehyde, 4-[(acetyloxy)methyl]- structure
919530-89-5 structure
Product Name:2-Furancarboxaldehyde, 4-[(acetyloxy)methyl]-
CAS No:919530-89-5
MF:C8H8O4
MW:168.146722793579
CID:761853
PubChem ID:22368338
Update Time:2025-04-19

2-Furancarboxaldehyde, 4-[(acetyloxy)methyl]- Chemical and Physical Properties

Names and Identifiers

    • 2-Furancarboxaldehyde, 4-[(acetyloxy)methyl]-
    • (5-formylfuran-3-yl)methyl acetate
    • 919530-89-5
    • DTXSID20625239
    • SCHEMBL697533
    • Inchi: 1S/C8H8O4/c1-6(10)11-4-7-2-8(3-9)12-5-7/h2-3,5H,4H2,1H3
    • InChI Key: WUUUDNOHBDZGIV-UHFFFAOYSA-N
    • SMILES: O1C(C=O)=CC(=C1)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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