Cas no 162872-01-7 (1,4,7,10-Tetraphosphadecane,1,1,4,7,10,10-hexaphenyl-, (4S,7S)-)

1,4,7,10-Tetraphosphadecane,1,1,4,7,10,10-hexaphenyl-, (4S,7S)- structure
162872-01-7 structure
Product Name:1,4,7,10-Tetraphosphadecane,1,1,4,7,10,10-hexaphenyl-, (4S,7S)-
CAS No:162872-01-7
MF:C42H42P4
MW:670.677934169769
CID:110070
Update Time:2024-01-24

1,4,7,10-Tetraphosphadecane,1,1,4,7,10,10-hexaphenyl-, (4S,7S)- Chemical and Physical Properties

Names and Identifiers

    • 1,4,7,10-Tetraphosphadecane,1,1,4,7,10,10-hexaphenyl-, (4S,7S)-
    • (+)-TETRAPHOS
    • (4S,7S)-(+)-1,1,4,7,10,10-HEXAPHENYL-1,4,7,10-TETRAPHOSPHADECANE
    • (R(*),R(*))-(+-)
    • 1,1,4,7,10,10-Hexaphenyl-1,4,7,10-tetraphosphadecan
    • 1.1.4.7.10.10-Hexaphenyl-1.4.7.10-tetraphosphadecan
    • R(*),S(*)-1,1,4,7,10,10-hexaphenyl-1,4,7,10-tetraphosphadecane
    • 1,4,7,10-Tetraphosphadecane, 1,1,4,7,10,10-hexaphenyl-, (4S,7S)-
    • Inchi： 1S/C42H42P4/c1-7-19-37(20-8-1)43(33-35-45(39-23-11-3-12-24-39)40-25-13-4-14-26-40)31-32-44(38-21-9-2-10-22-38)34-36-46(41-27-15-5-16-28-41)42-29-17-6-18-30-42/h1-30H,31-36H2/t43-,44-/m0/s1
    • InChI Key： TXFNTLLEAYZBGV-CXNSMIOJSA-N
    • SMILES： P(C1=CC=CC=C1)(C1=CC=CC=C1)CC[P@@](C1=CC=CC=C1)CC[P@](C1=CC=CC=C1)CCP(C1=CC=CC=C1)C1=CC=CC=C1

Computed Properties

  • Exact Mass: 298.13000
  • Monoisotopic Mass: 670.224
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 46
  • Rotatable Bond Count: 15
  • Complexity: 680
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 0A^2

Experimental Properties

  • Boiling Point: 758.5±55.0 °C(Predicted)
  • PSA: 54.36000
  • LogP: 4.69280

1,4,7,10-Tetraphosphadecane,1,1,4,7,10,10-hexaphenyl-, (4S,7S)- Related Literature

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