Cas no 88981-55-9 (Phosphonium, [1-(diphenylphosphino)ethenyl]methyldiphenyl-, iodide)

Phosphonium, [1-(diphenylphosphino)ethenyl]methyldiphenyl-, iodide structure
88981-55-9 structure
Product Name:Phosphonium, [1-(diphenylphosphino)ethenyl]methyldiphenyl-, iodide
CAS No:88981-55-9
MF:C27H25IP2
MW:538.339401006699
CID:617204
PubChem ID:71321204
Update Time:2025-04-19

Phosphonium, [1-(diphenylphosphino)ethenyl]methyldiphenyl-, iodide Chemical and Physical Properties

Names and Identifiers

    • Phosphonium, [1-(diphenylphosphino)ethenyl]methyldiphenyl-, iodide
    • 1-diphenylphosphanylethenyl-methyl-diphenylphosphanium,iodide
    • DTXSID00751045
    • [1-(Diphenylphosphanyl)ethenyl](methyl)diphenylphosphanium iodide
    • 88981-55-9
    • Inchi: 1S/C27H25P2.HI/c1-23(28(24-15-7-3-8-16-24)25-17-9-4-10-18-25)29(2,26-19-11-5-12-20-26)27-21-13-6-14-22-27;/h3-22H,1H2,2H3;1H/q+1;/p-1
    • InChI Key: XRKJNZUYEHNCJK-UHFFFAOYSA-M
    • SMILES: [I-].[P+](C)(C1C=CC=CC=1)(C1C=CC=CC=1)C(=C)P(C1C=CC=CC=1)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 538.04762g/mol
  • Monoisotopic Mass: 538.04762g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 6
  • Complexity: 467
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 27.18000
  • LogP: 2.89290
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