Cas no 113447-58-8 (4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-(4-hydroxyphenyl)ethyl]-2,6-dimethylphenol)

4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-(4-hydroxyphenyl)ethyl]-2,6-dimethylphenol structure
113447-58-8 structure
Product Name:4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-(4-hydroxyphenyl)ethyl]-2,6-dimethylphenol
CAS No:113447-58-8
MF:C24H26O3
MW:362.461447238922
CID:2610841
PubChem ID:57935526
Update Time:2025-04-21

4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-(4-hydroxyphenyl)ethyl]-2,6-dimethylphenol Chemical and Physical Properties

Names and Identifiers

    • 4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-(4-hydroxyphenyl)ethyl]-2,6-dimethylphenol
    • 4,4'-[1-(4-Hydroxyphenyl)ethane-1,1-diyl]bis(2,6-dimethylphenol)
    • SCHEMBL13609942
    • 113447-58-8
    • DTXSID40728317
    • Inchi: 1S/C24H26O3/c1-14-10-19(11-15(2)22(14)26)24(5,18-6-8-21(25)9-7-18)20-12-16(3)23(27)17(4)13-20/h6-13,25-27H,1-5H3
    • InChI Key: QNFAAUDLDIZZBD-UHFFFAOYSA-N
    • SMILES: OC1C(C)=CC(=CC=1C)C(C)(C1C=CC(=CC=1)O)C1C=C(C)C(=C(C)C=1)O

Computed Properties

  • Exact Mass: 362.18819469Da
  • Monoisotopic Mass: 362.18819469Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 27
  • Rotatable Bond Count: 3
  • Complexity: 430
  • 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: 6.2
  • Topological Polar Surface Area: 60.7?2

4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-(4-hydroxyphenyl)ethyl]-2,6-dimethylphenol Related Literature

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