Cas no 797762-96-0 (Benzaldehyde,3,5-diethoxy-2-hydroxy-4-methyl-)

Benzaldehyde,3,5-diethoxy-2-hydroxy-4-methyl- structure
797762-96-0 structure
Product Name:Benzaldehyde,3,5-diethoxy-2-hydroxy-4-methyl-
CAS No:797762-96-0
MF:C12H16O4
MW:224.253044128418
CID:556654
PubChem ID:45097868
Update Time:2025-04-19

Benzaldehyde,3,5-diethoxy-2-hydroxy-4-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde,3,5-diethoxy-2-hydroxy-4-methyl-
    • 3,5-diethoxy-2-hydroxy-4-methylbenzaldehyde
    • Benzaldehyde, 3,5-diethoxy-2-hydroxy-4-methyl- (9CI)
    • 797762-96-0
    • DTXSID60667638
    • Inchi: 1S/C12H16O4/c1-4-15-10-6-9(7-13)11(14)12(8(10)3)16-5-2/h6-7,14H,4-5H2,1-3H3
    • InChI Key: GWLRLJUKHLKJNF-UHFFFAOYSA-N
    • SMILES: O(CC)C1C(=C(C=O)C=C(C=1C)OCC)O

Computed Properties

  • Exact Mass: 224.105
  • Monoisotopic Mass: 224.105
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 219
  • 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
  • Topological Polar Surface Area: 55.8A^2
  • XLogP3: 2.6
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