Cas no 133358-62-0 (1,1':4',1''-Terphenyl, 4-(1,1-dimethylethyl)-)

1,1':4',1''-Terphenyl, 4-(1,1-dimethylethyl)- structure
133358-62-0 structure
Product Name:1,1':4',1''-Terphenyl, 4-(1,1-dimethylethyl)-
CAS No:133358-62-0
MF:C22H22
MW:286.410086154938
CID:1238073
PubChem ID:21910028
Update Time:2025-04-20

1,1':4',1''-Terphenyl, 4-(1,1-dimethylethyl)- Chemical and Physical Properties

Names and Identifiers

    • 1,1':4',1''-Terphenyl, 4-(1,1-dimethylethyl)-
    • 1-tert-butyl-4-(4-phenylphenyl)benzene
    • 1~4~-tert-Butyl-1~1~,2~1~:2~4~,3~1~-terphenyl
    • 133358-62-0
    • DTXSID20619951
    • Inchi: 1S/C22H22/c1-22(2,3)21-15-13-20(14-16-21)19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-16H,1-3H3
    • InChI Key: IAHHHZBPQZNCFG-UHFFFAOYSA-N
    • SMILES: C(C)(C)(C)C1C=CC(C2C=CC(C3C=CC=CC=3)=CC=2)=CC=1

Computed Properties

  • Exact Mass: 286.17226
  • Monoisotopic Mass: 286.172150702g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 3
  • Complexity: 314
  • 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: 7.4
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0
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