Cas no 73340-64-4 (Benzene, 1,3,5-tris[(phenylthio)methyl]-)

Benzene, 1,3,5-tris[(phenylthio)methyl]- structure
73340-64-4 structure
Product Name:Benzene, 1,3,5-tris[(phenylthio)methyl]-
CAS No:73340-64-4
MF:C27H24S3
MW:444.674463272095
CID:542632
PubChem ID:71404226
Update Time:2025-04-19

Benzene, 1,3,5-tris[(phenylthio)methyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzene, 1,3,5-tris[(phenylthio)methyl]-
    • 1,3,5-tris(phenylsulfanylmethyl)benzene
    • DTXSID90825082
    • 1,1',1''-[Benzene-1,3,5-triyltris(methylenesulfanediyl)]tribenzene
    • 73340-64-4
    • Inchi: 1S/C27H24S3/c1-4-10-25(11-5-1)28-19-22-16-23(20-29-26-12-6-2-7-13-26)18-24(17-22)21-30-27-14-8-3-9-15-27/h1-18H,19-21H2
    • InChI Key: UWGWLCAUNOVKRP-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=CC=1)CC1C=C(CSC2C=CC=CC=2)C=C(CSC2C=CC=CC=2)C=1

Computed Properties

  • Exact Mass: 444.10401429g/mol
  • Monoisotopic Mass: 444.10401429g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 9
  • Complexity: 371
  • 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: 7.9
  • Topological Polar Surface Area: 75.9?2
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