Cas no 141546-10-3 (1,4-Benzenediamine, N,N'-bis[4-(diphenylamino)phenyl]-N,N'-diphenyl-)

1,4-Benzenediamine, N,N'-bis[4-(diphenylamino)phenyl]-N,N'-diphenyl- structure
141546-10-3 structure
Product Name:1,4-Benzenediamine, N,N'-bis[4-(diphenylamino)phenyl]-N,N'-diphenyl-
CAS No:141546-10-3
MF:C54H42N4
MW:746.938092708588
CID:1313201
PubChem ID:22338822
Update Time:2025-04-20

1,4-Benzenediamine, N,N'-bis[4-(diphenylamino)phenyl]-N,N'-diphenyl- Chemical and Physical Properties

Names and Identifiers

    • 1,4-Benzenediamine, N,N'-bis[4-(diphenylamino)phenyl]-N,N'-diphenyl-
    • 1-N,1-N,4-N-triphenyl-4-N-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]benzene-1,4-diamine
    • DTXSID60624968
    • N~4~,N~4'~-(1,4-Phenylene)bis(N~1~,N~1~,N~4~-triphenylbenzene-1,4-diamine)
    • SCHEMBL2389596
    • 141546-10-3
    • Inchi: 1S/C54H42N4/c1-7-19-43(20-8-1)55(44-21-9-2-10-22-44)49-31-35-51(36-32-49)57(47-27-15-5-16-28-47)53-39-41-54(42-40-53)58(48-29-17-6-18-30-48)52-37-33-50(34-38-52)56(45-23-11-3-12-24-45)46-25-13-4-14-26-46/h1-42H
    • InChI Key: OLUMNEXGMXIAMJ-UHFFFAOYSA-N
    • SMILES: N(C1C=CC=CC=1)(C1C=CC(=CC=1)N(C1C=CC=CC=1)C1C=CC=CC=1)C1C=CC(=CC=1)N(C1C=CC=CC=1)C1C=CC(=CC=1)N(C1C=CC=CC=1)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 746.34126
  • Monoisotopic Mass: 746.34094736g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 58
  • Rotatable Bond Count: 12
  • Complexity: 1000
  • 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: 14.9
  • Topological Polar Surface Area: 13?2

Experimental Properties

  • PSA: 12.96
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