Cas no 61110-15-4 (Benzaldehyde, 6-hydroxy-2,4-dimethoxy-3-methyl-)

Benzaldehyde, 6-hydroxy-2,4-dimethoxy-3-methyl- structure
61110-15-4 structure
Product Name:Benzaldehyde, 6-hydroxy-2,4-dimethoxy-3-methyl-
CAS No:61110-15-4
MF:C10H12O4
MW:196.199883460999
CID:491657
PubChem ID:71399283
Update Time:2025-04-19

Benzaldehyde, 6-hydroxy-2,4-dimethoxy-3-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde, 6-hydroxy-2,4-dimethoxy-3-methyl-
    • 6-hydroxy-2,4-dimethoxy-3-methylbenzaldehyde
    • 61110-15-4
    • DTXSID90820653
    • Inchi: 1S/C10H12O4/c1-6-9(13-2)4-8(12)7(5-11)10(6)14-3/h4-5,12H,1-3H3
    • InChI Key: ATUJNYCVZLLGBG-UHFFFAOYSA-N
    • SMILES: O(C)C1C(C=O)=C(C=C(C=1C)OC)O

Computed Properties

  • Exact Mass: 196.07356
  • Monoisotopic Mass: 196.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 195
  • 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: 1.9
  • Topological Polar Surface Area: 55.8?2

Experimental Properties

  • PSA: 55.76

Benzaldehyde, 6-hydroxy-2,4-dimethoxy-3-methyl- Related Literature

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