Cas no 122271-46-9 (Benzenemethanol,3-hydroxy-4,5-dimethoxy-)

Benzenemethanol,3-hydroxy-4,5-dimethoxy- structure
122271-46-9 structure
Product Name:Benzenemethanol,3-hydroxy-4,5-dimethoxy-
CAS No:122271-46-9
MF:C9H12O4
MW:184.189183235168
CID:133496
PubChem ID:10921182
Update Time:2025-04-19

Benzenemethanol,3-hydroxy-4,5-dimethoxy- Chemical and Physical Properties

Names and Identifiers

    • Benzenemethanol,3-hydroxy-4,5-dimethoxy-
    • 3,4-DIMETHOXY-5-HYDROXYBENZYL ALCOHOL
    • 5-(hydroxymethyl)-2,3-dimethoxyphenol
    • 3-hydroxy-4,5-dimethoxybenzyl alcohol
    • Benzenemethanol,3-hydroxy-4,5-dimethoxy
    • RARECHEM AL BD 0681
    • DTXSID50448372
    • FT-0692632
    • SCHEMBL3364601
    • 122271-46-9
    • 3,4-DIMETHOXY-5-HYDROXYBENZYLALCOHOL
    • AKOS006272221
    • Inchi: 1S/C9H12O4/c1-12-8-4-6(5-10)3-7(11)9(8)13-2/h3-4,10-11H,5H2,1-2H3
    • InChI Key: YEROGNXNQJEQDX-UHFFFAOYSA-N
    • SMILES: O(C)C1C=C(CO)C=C(C=1OC)O

Computed Properties

  • Exact Mass: 184.07400
  • Monoisotopic Mass: 184.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 151
  • 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: 0.6
  • Topological Polar Surface Area: 58.9?2

Experimental Properties

  • PSA: 58.92000
  • LogP: 0.90170
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