Cas no 2990-31-0 (Benzaldehyde,4,6-dihydroxy-2,3-dimethyl-)

Benzaldehyde,4,6-dihydroxy-2,3-dimethyl- structure
2990-31-0 structure
Product Name:Benzaldehyde,4,6-dihydroxy-2,3-dimethyl-
CAS No:2990-31-0
MF:C9H10O3
MW:166.173902988434
CID:265099
PubChem ID:254155
Update Time:2025-04-19

Benzaldehyde,4,6-dihydroxy-2,3-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde,4,6-dihydroxy-2,3-dimethyl-
    • 4,6-dihydroxy-2,3-dimethylbenzaldehyde
    • 2,4-Dihydroxy-5,6-dimethylbenzaldehyd
    • 2,4-Dihydroxy-5,6-dimethyl-benzaldehyd
    • 2,4-dihydroxy-5,6-dimethylbenzaldehyde
    • 4,6-Dihydroxy-2,3-dimethyl-benzaldehyd
    • 4,6-dihydroxy-2,3-dimethyl-benzaldehyde
    • 5-Methylorcylaldehyd
    • 5-Methylorcylaldehyde
    • AC1L5PNC
    • AC1Q6Q19
    • AR-1H7897
    • CTK4G4025
    • NSC77993
    • 2,4-dihydroxy 5,6-dimethyl benzaldehyde
    • NSC-77993
    • 4,6-Dihydroxy-2,3-dimethylbenzaldehyde #
    • .beta.-Resorcylaldehyde, 5,6-dimethyl-
    • 2990-31-0
    • DTXSID50291789
    • 5,6-dimethyl-beta-resorcylaldehyde
    • SCHEMBL10470456
    • CHEBI:146173
    • .beta.-Resorcylaldehyde,6-dimethyl-
    • 2,4-dihydroxy 5,6-dimethylbenzaldehyde
    • Benzaldehyde,6-dihydroxy-2,3-dimethyl-
    • Benzaldehyde, 4,6-dihydroxy-2,3-dimethyl-
    • Inchi: 1S/C9H10O3/c1-5-6(2)8(11)3-9(12)7(5)4-10/h3-4,11-12H,1-2H3
    • InChI Key: LQIYIUJTJNQJTJ-UHFFFAOYSA-N
    • SMILES: OC1=CC(=C(C=O)C(C)=C1C)O

Computed Properties

  • Exact Mass: 166.063
  • Monoisotopic Mass: 166.063
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 169
  • 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: 2
  • Topological Polar Surface Area: 57.5?2

Experimental Properties

  • Density: 1.273
  • Boiling Point: 328.9°Cat760mmHg
  • Flash Point: 166.9°C
  • Refractive Index: 1.629
  • PSA: 57.53
  • LogP: 1.52710
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