Cas no 67730-48-7 (2,6-Bis(hydroxymethyl)-3,4-dimethylphenol)

2,6-Bis(hydroxymethyl)-3,4-dimethylphenol structure
67730-48-7 structure
Product Name:2,6-Bis(hydroxymethyl)-3,4-dimethylphenol
CAS No:67730-48-7
MF:C10H14O3
MW:182.216363430023
CID:2798316
PubChem ID:18792541
Update Time:2025-04-21

2,6-Bis(hydroxymethyl)-3,4-dimethylphenol Chemical and Physical Properties

Names and Identifiers

    • 2,6-Dimethylol-4,5-dimethylphenol
    • SCHEMBL2219441
    • 67730-48-7
    • DTXCID00547081
    • BHPFXDABRSZTIL-UHFFFAOYSA-N
    • DTXSID20596319
    • 2,6-Bis(hydroxymethyl)-3,4-dimethylphenol
    • Inchi: 1S/C10H14O3/c1-6-3-8(4-11)10(13)9(5-12)7(6)2/h3,11-13H,4-5H2,1-2H3
    • InChI Key: BHPFXDABRSZTIL-UHFFFAOYSA-N
    • SMILES: OC1=C(CO)C=C(C)C(C)=C1CO

Computed Properties

  • Exact Mass: 182.094294304Da
  • Monoisotopic Mass: 182.094294304Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 160
  • 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: 1.1
  • Topological Polar Surface Area: 60.7?2
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