Cas no 59276-27-6 (Phenol, 4-(dimethoxymethyl)-)

Phenol, 4-(dimethoxymethyl)- structure
Phenol, 4-(dimethoxymethyl)- structure
Product Name:Phenol, 4-(dimethoxymethyl)-
CAS No:59276-27-6
MF:C9H12O3
MW:168.189783096313
CID:339306
PubChem ID:11052043
Update Time:2025-04-19

Phenol, 4-(dimethoxymethyl)- Chemical and Physical Properties

Names and Identifiers

    • Phenol, 4-(dimethoxymethyl)-
    • 4-(dimethoxymethyl)phenol
    • BILVBEQFRBOGAV-UHFFFAOYSA-N
    • 4-dimethoxymethyl phenol
    • SCHEMBL5142966
    • DTXSID90453369
    • 59276-27-6
    • CS-0497956
    • 4-Dimethoxymethylphenol
    • Inchi: 1S/C9H12O3/c1-11-9(12-2)7-3-5-8(10)6-4-7/h3-6,9-10H,1-2H3
    • InChI Key: BILVBEQFRBOGAV-UHFFFAOYSA-N
    • SMILES: O(C)C(C1C=CC(=CC=1)O)OC

Computed Properties

  • Exact Mass: 168.07866
  • Monoisotopic Mass: 168.078644241g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 115
  • 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: 1.2
  • Topological Polar Surface Area: 38.7?2

Experimental Properties

  • PSA: 38.69
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