N,N-Bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-1,4-benzenediamine | CAS No. 105389-36-4

N,N-Bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-1,4-benzenediamine

Basic Information

CAS Number

105389-36-4

Molecular Formula

C54H42N4

Molecular Weight

746.96 g/mol

AD

Basic Physical Properties

Melting Point

245.0 to 249.0 deg-C

Density

1.216

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)N(C4=CC=C(C=C4)N(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C54H42N4/c1-7-19-43(20-8-1)55(44-21-9-2-10-22-44)49-31-37-52(38-32-49)58(53-39-33-50(34-40-53)56(45-23-11-3-12-24-45)46-25-13-4-14-26-46)54-41-35-51(36-42-54)57(47-27-15-5-16-28-47)48-29-17-6-18-30-48/h1-42H

InChIKey

IYZMXHQDXZKNCY-UHFFFAOYSA-N

LogP

15.565799999999964

Topological Polar Surface Area

12.96 Ų

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

933

Synonyms & References

English

  • FT-0737353
  • T3062
  • 1,4-Benzenediamine, N,N-bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-
  • 4,4',4'-Tris(N,N-diphenylamino)triphenylamine [TDATA]
  • 4,4',4''-Tris(diphenylamino)triphenylamine, >/=97%
  • 4,4',4'-Tris(N,N-diphenyl-amino)-triphenylamine
  • N1,N1-Bis(4-(diphenylamino)phenyl)-N4,N4-diphenylbenzene-1,4-diamine
  • 4,4',4''-Tris(diphenylamino)triphenylamine
  • AS-72382
  • AKOS005145700
  • N1,N1-bis[4-(diphenylamino)phenyl]-N4,N4-diphenylbenzene-1,4-diamine
  • 4,4',4''-Tris(n,n-diphenylamino)triphenylamine
  • TDATA
  • A851661
  • 4,4,4-TRIS(N,N-DIPHENYL-AMINO)-TRIPHENYLAMINE
  • tris(4-diphenylaminophenyl)amine
  • 1-N,1-N-diphenyl-4-N,4-N-bis[4-(N-phenylanilino)phenyl]benzene-1,4-diamine
  • 4,4'4'-tris(n,n-diphenylamino)triphenylamine
  • 4,4,4-Tris(N,N-diphenylamino)triphenylamine [TDATA]
  • MFCD01310677
  • DTXSID30449463
  • T71563
  • 4,4',4'-tris(n,n-diphenyl-amino)triphenylamine
  • SCHEMBL36869
  • 105389-36-4
  • 4,4',4'-TRIS(N,N-DIPHENYL-AMINO)-TRIPHENYL AMINE
  • 4,4,4" -Tris(N,N-Diphenyl-Amino)Triphenylamine
  • 4,4',4"-tris-(diphenylamino)triphenylamine
  • 4,4',4''-tris(N,N-diphenyl-amino)-triphenylamine
  • 1,4-Benzenediamine,N,N-bis[4-(diphenylamino)phenyl]-N',N'-diphenyl- (9CI)
  • 4,4',4''-Tris(N,N-diphenylamino)triphenylamine

MDL Number

MFCD01310677

Customs Code

2921590090

FAQ

What are the physical and chemical properties of N,N-Bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-1,4-benzenediamine (CAS: 105389-36-4)?

N,N-Bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-1,4-benzenediamine is a crystalline compound with a high molecular weight. It has limited water solubility but is soluble in organic solvents like chloroform and dichloromethane. This compound is highly reactive due to its aromatic nature and can undergo electrophilic aromatic substitution reactions. It is also susceptible to oxidation and photodegradation.

How is N,N-Bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-1,4-benzenediamine (CAS: 105389-36-4) typically synthesized?

N,N-Bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-1,4-benzenediamine is synthesized through multistep organic synthesis involving the coupling of diphenylamine with 1,4-benzenediamine. The reaction requires refluxing in an appropriate solvent and can be carried out using common catalysts like palladium complexes. The yield is good, and the selectivity is high.

What industries use N,N-Bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-1,4-benzenediamine (CAS: 105389-36-4)?

N,N-Bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-1,4-benzenediamine is primarily used in the pharmaceutical and polymer industries. It acts as an electron-donating material in organic electronic devices and is also used as a photoreactive compound in various applications. Its use in sensors and semiconductors is also expanding due to its unique properties.

What precautions should be taken when handling N,N-Bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-1,4-benzenediamine (CAS: 105389-36-4)?

When handling N,N-Bis[4-(diphenylamino)phenyl]-N',N'-diphenyl-1,4-benzenediamine, it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or fume hood to minimize exposure. Spills should be cleaned up immediately using appropriate absorbents, and proper disposal methods should be followed. Safety data sheets (SDS) should always be consulted for detailed handling and disposal information.

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