Cas no 395059-22-0 ([2,5-Bis(2,2-diphenylethenyl)-1,4-phenylene]dimethanol)

[2,5-Bis(2,2-diphenylethenyl)-1,4-phenylene]dimethanol structure
395059-22-0 structure
Product Name:[2,5-Bis(2,2-diphenylethenyl)-1,4-phenylene]dimethanol
CAS No:395059-22-0
MF:C36H30O2
MW:494.622210025787
CID:2825464
PubChem ID:71359242
Update Time:2025-04-21

[2,5-Bis(2,2-diphenylethenyl)-1,4-phenylene]dimethanol Chemical and Physical Properties

Names and Identifiers

    • [2,5-Bis(2,2-diphenylethenyl)-1,4-phenylene]dimethanol
    • 395059-22-0
    • DTXSID10783099
    • Inchi: 1S/C36H30O2/c37-25-33-22-32(24-36(29-17-9-3-10-18-29)30-19-11-4-12-20-30)34(26-38)21-31(33)23-35(27-13-5-1-6-14-27)28-15-7-2-8-16-28/h1-24,37-38H,25-26H2
    • InChI Key: NXDWDFHWJYDISU-UHFFFAOYSA-N
    • SMILES: OCC1C=C(/C=C(\C2C=CC=CC=2)/C2C=CC=CC=2)C(CO)=CC=1/C=C(\C1C=CC=CC=1)/C1C=CC=CC=1

Computed Properties

  • Exact Mass: 494.224580195Da
  • Monoisotopic Mass: 494.224580195Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 38
  • Rotatable Bond Count: 8
  • Complexity: 639
  • 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: 8.5
  • Topological Polar Surface Area: 40.5?2
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