Cas no 80749-72-0 (Benzaldehyde, 4-hydroxy-2,5-dimethoxy-)

Benzaldehyde, 4-hydroxy-2,5-dimethoxy- structure
80749-72-0 structure
Product Name:Benzaldehyde, 4-hydroxy-2,5-dimethoxy-
CAS No:80749-72-0
MF:C9H10O4
MW:182.173303127289
CID:705093
PubChem ID:14920977
Update Time:2025-04-19

Benzaldehyde, 4-hydroxy-2,5-dimethoxy- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde, 4-hydroxy-2,5-dimethoxy-
    • 4-hydroxy-2,5-dimethoxybenzaldehyde
    • BAMYKVUGRCKVHP-UHFFFAOYSA-N
    • SCHEMBL1002368
    • 80749-72-0
    • 4-hydroxy-2,5dimethoxybenzaldehyde
    • DTXSID70565439
    • Inchi: 1S/C9H10O4/c1-12-8-4-7(11)9(13-2)3-6(8)5-10/h3-5,11H,1-2H3
    • InChI Key: BAMYKVUGRCKVHP-UHFFFAOYSA-N
    • SMILES: O(C)C1C=C(C(=CC=1C=O)OC)O

Computed Properties

  • Exact Mass: 182.05790880g/mol
  • Monoisotopic Mass: 182.05790880g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 171
  • 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
  • Topological Polar Surface Area: 55.8?2
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