Cas no 129510-09-4 (4-[1-(4-Hydroxyphenyl)-3,3-dimethylcyclohexyl]phenol)

4-[1-(4-Hydroxyphenyl)-3,3-dimethylcyclohexyl]phenol structure
129510-09-4 structure
Product Name:4-[1-(4-Hydroxyphenyl)-3,3-dimethylcyclohexyl]phenol
CAS No:129510-09-4
MF:C20H24O2
MW:296.403366088867
CID:2769746
PubChem ID:21940741
Update Time:2025-04-21

4-[1-(4-Hydroxyphenyl)-3,3-dimethylcyclohexyl]phenol Chemical and Physical Properties

Names and Identifiers

    • 129510-09-4
    • DTXSID00620449
    • SCHEMBL669016
    • 2~3~,2~3~-Dimethyl-2~3~,2~4~,2~5~,2~6~-tetrahydro-2~2~H-[1~1~,2~1~:2~1~,3~1~-terphenyl]-1~4~,3~4~-diol
    • 4-[1-(4-Hydroxyphenyl)-3,3-dimethylcyclohexyl]phenol
    • Inchi: 1S/C20H24O2/c1-19(2)12-3-13-20(14-19,15-4-8-17(21)9-5-15)16-6-10-18(22)11-7-16/h4-11,21-22H,3,12-14H2,1-2H3
    • InChI Key: IIQVXZZBIGSGIL-UHFFFAOYSA-N
    • SMILES: OC1C=CC(=CC=1)C1(C2C=CC(=CC=2)O)CCCC(C)(C)C1

Computed Properties

  • Exact Mass: 296.177630004Da
  • Monoisotopic Mass: 296.177630004Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 2
  • Complexity: 338
  • 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: 6.1
  • Topological Polar Surface Area: 40.5?2

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