Cas no 138796-77-7 ([1,1':4',1''-Terphenyl]-4-amine, N,N-bis(4'-methyl[1,1'-biphenyl]-4-yl)-)

[1,1':4',1''-Terphenyl]-4-amine, N,N-bis(4'-methyl[1,1'-biphenyl]-4-yl)- structure
138796-77-7 structure
Product Name:[1,1':4',1''-Terphenyl]-4-amine, N,N-bis(4'-methyl[1,1'-biphenyl]-4-yl)-
CAS No:138796-77-7
MF:C44H35N
MW:577.75541138649
CID:1255668
Update Time:2024-08-04

[1,1':4',1''-Terphenyl]-4-amine, N,N-bis(4'-methyl[1,1'-biphenyl]-4-yl)- Chemical and Physical Properties

Names and Identifiers

    • [1,1':4',1''-Terphenyl]-4-amine, N,N-bis(4'-methyl[1,1'-biphenyl]-4-yl)-
    • [1,1':4',1''-Terphenyl]-4-amine, N,N-bis(4'-methyl[1,1'-biphenyl]-4-yl)- (9CI)
    • Inchi: 1S/C44H35N/c1-32-8-12-35(13-9-32)39-20-26-42(27-21-39)45(43-28-22-40(23-29-43)36-14-10-33(2)11-15-36)44-30-24-41(25-31-44)38-18-16-37(17-19-38)34-6-4-3-5-7-34/h3-31H,1-2H3
    • InChI Key: UUMIJLKQNDRWDE-UHFFFAOYSA-N
    • SMILES: C1(C2=CC=C(C3=CC=CC=C3)C=C2)=CC=C(N(C2=CC=C(C3=CC=C(C)C=C3)C=C2)C2=CC=C(C3=CC=C(C)C=C3)C=C2)C=C1

Computed Properties

  • Exact Mass: 577.27715

Experimental Properties

  • Density: 1.123±0.06 g/cm3(Predicted)
  • Boiling Point: 770.4±59.0 °C(Predicted)
  • PSA: 3.24
  • pka: -2.66±0.60(Predicted)
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