Cas no 102146-60-1 (6,6'-([1,1'-Biphenyl]-4,4'-diyl)bis(2,4-diphenylnicotinonitrile))

6,6'-([1,1'-Biphenyl]-4,4'-diyl)bis(2,4-diphenylnicotinonitrile) structure
102146-60-1 structure
Product Name:6,6'-([1,1'-Biphenyl]-4,4'-diyl)bis(2,4-diphenylnicotinonitrile)
CAS No:102146-60-1
MF:C48H30N4
MW:662.778610706329
CID:2623281
PubChem ID:13501476
Update Time:2025-04-21

6,6'-([1,1'-Biphenyl]-4,4'-diyl)bis(2,4-diphenylnicotinonitrile) Chemical and Physical Properties

Names and Identifiers

    • 6,6'-([1,1'-Biphenyl]-4,4'-diyl)bis(2,4-diphenylpyridine-3-carbonitrile)
    • 102146-60-1
    • 6,6'-([1,1'-Biphenyl]-4,4'-diyl)bis(2,4-diphenylnicotinonitrile)
    • DTXSID60542350
    • Inchi： 1S/C48H30N4/c49-31-43-41(35-13-5-1-6-14-35)29-45(51-47(43)39-17-9-3-10-18-39)37-25-21-33(22-26-37)34-23-27-38(28-24-34)46-30-42(36-15-7-2-8-16-36)44(32-50)48(52-46)40-19-11-4-12-20-40/h1-30H
    • InChI Key： ICMQOAIMMZNGIQ-UHFFFAOYSA-N
    • SMILES： N1C(C2C=CC=CC=2)=C(C#N)C(C2C=CC=CC=2)=CC=1C1C=CC(=CC=1)C1C=CC(=CC=1)C1C=C(C2C=CC=CC=2)C(C#N)=C(C2C=CC=CC=2)N=1

Computed Properties

  • Exact Mass: 662.247047g/mol
  • Monoisotopic Mass: 662.247047g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 52
  • Rotatable Bond Count: 7
  • Complexity: 1090
  • 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
  • Molecular Weight: 662.8g/mol
  • XLogP3: 10.7
  • Topological Polar Surface Area: 73.4?2

6,6'-([1,1'-Biphenyl]-4,4'-diyl)bis(2,4-diphenylnicotinonitrile) Related Literature

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