Cas no 2931-89-7 (1,3-Benzenedicarboxaldehyde,5-ethoxy-4-hydroxy-)

1,3-Benzenedicarboxaldehyde,5-ethoxy-4-hydroxy- structure
2931-89-7 structure
Product Name:1,3-Benzenedicarboxaldehyde,5-ethoxy-4-hydroxy-
CAS No:2931-89-7
MF:C10H10O4
MW:194.184003353119
CID:258597
PubChem ID:18034
Update Time:2025-04-19

1,3-Benzenedicarboxaldehyde,5-ethoxy-4-hydroxy- Chemical and Physical Properties

Names and Identifiers

    • 1,3-Benzenedicarboxaldehyde,5-ethoxy-4-hydroxy-
    • 5-ethoxy-4-hydroxybenzene-1,3-dicarbaldehyde
    • 1-hydroxy-2-ethoxy-4,6-diformylbenzene
    • 4-Hydroxy-5-ethoxy-isophthalaldehyd
    • 5-Ethoxy-4-hydroxyisophthalaldehyde
    • AC1L2B7T
    • AG-E-95388
    • BRN 3032383
    • CTK4G3107
    • Dialdehyde ethylvanillique
    • Dialdehyde ethylvanillique [French]
    • ISOPHTHALALDEHYDE, 5-ETHOXY-4-HYDROXY-
    • 2931-89-7
    • 2-Ethoxy-4,6-diformylphenol
    • 1,3-Benzenedicarboxaldehyde, 5-ethoxy-4-hydroxy-
    • 5-formyl ethylvanillin
    • DTXSID10183555
    • 5-Ethoxy-4-hydroxy-1,3-benzenedicarboxaldehyde
    • Q63395650
    • 2GK2LR5KGL
    • 2,4-DIFORMYL-6-ETHOXYPHENOL
    • SCHEMBL1527149
    • Ethylvanillic dialdehyde
    • Inchi: 1S/C10H10O4/c1-2-14-9-4-7(5-11)3-8(6-12)10(9)13/h3-6,13H,2H2,1H3
    • InChI Key: WQWNVPGJVKVZDH-UHFFFAOYSA-N
    • SMILES: O(CC)C1C=C(C=O)C=C(C=O)C=1O

Computed Properties

  • Exact Mass: 194.0579
  • Monoisotopic Mass: 194.057909
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 204
  • 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: 63.6
  • XLogP3: 1.4

Experimental Properties

  • Density: 1.279
  • Boiling Point: 320.6°C at 760 mmHg
  • Flash Point: 126.4°C
  • Refractive Index: 1.615
  • PSA: 63.6
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