ChemicalBook--->CAS DataBase List--->531-91-9

531-91-9

531-91-9 Structure

531-91-9 Structure
IdentificationMore
[Name]

N,N'-Diphenylbenzidine
[CAS]

531-91-9
[Synonyms]

4,4'-BIS(ANILINO)BIPHENYL
4,4'-DIANILINOBIPHENYL
N,N'-DIPHENYLBENZIDINE
N,N'-DIPHENYL BIPHENYLAMINE
SYM-DIPHENYLBENZIDINE
TIMTEC-BB SBB002946
(4),N(4')-Diphenyl-biphenyl-4,4'-diamine
1’-biphenyl]-4,4’-diamine,n,n’-diphenyl-[
Benzidine, N,N'-diphenyl-
Diphenylbenzidine
N,N-Diphenyl Diphenylamine
N,N-diphenylbenzidine (sym.)
N,N'-DiphenylBenzidineGr
1,1-Biphenyl-4,4-diamine, N,N-diphenyl-
DEPHENYLBENZIDINE
4,4'-Bis(phenylamino)biphenyl
N,N'-(1,1'-Biphenyl-4,4'-diyl)bisaniline
N,N'-Diphenyl-1,1'-biphenyl-4,4'-diamine
N,N'-Diphenyl-4,4'-biphenyldiamine
N,N'-Diphenylbiphenyl-4,4'-diamine
[EINECS(EC#)]

208-521-7
[Molecular Formula]

C24H20N2
[MDL Number]

MFCD00003016
[Molecular Weight]

336.43
[MOL File]

531-91-9.mol
Chemical PropertiesBack Directory
[Appearance]

GREY TO BROWNISH FINE CRYSTALLINE POWDER
[Melting point ]

246-248 °C(lit.)
[Boiling point ]

462.9°C (rough estimate)
[density ]

1.1750 (rough estimate)
[vapor density ]

11.6 (vs air)
[refractive index ]

1.7620 (estimate)
[Fp ]

>110°C
[storage temp. ]

Store below +30°C.
[solubility ]

Acetone (Slightly), DMF (Slightly), DMSO (Slightly), Ethyl Acetate (Slightly, Sonicated)
[form ]

Fine Crystalline Powder
[pka]

1.31±0.40(Predicted)
[color ]

Gray to brownish
[Water Solubility ]

Insoluble in water.
[Sensitive ]

Light Sensitive
[Merck ]

14,3319
[BRN ]

2220993
[InChIKey]

FDRNXKXKFNHNCA-UHFFFAOYSA-N
[CAS DataBase Reference]

531-91-9(CAS DataBase Reference)
[NIST Chemistry Reference]

[1,1'-Biphenyl]-4,4'-diamine, n,n'-diphenyl-(531-91-9)
[EPA Substance Registry System]

531-91-9(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
[RIDADR ]

2811
[WGK Germany ]

3
[F ]

8
[TSCA ]

Yes
[HazardClass ]

6.1(b)
[PackingGroup ]

III
[HS Code ]

29215900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sulfuric acid-->Acetic acid-->Xylene-->Sodium bisulfite-->Potassium dichromate-->Diphenylamine-->Benzenamine, N-hydroxy-N-phenyl--->2-Aminodiphenylamine-->1,1-DIPHENYLHYDRAZINE-->N-TRIMETHYLSILYLANILINE-->TETRAPHENYLHYDRAZINE-->4,4'-Dibromobiphenyl-->Benzidine-->Aniline
Hazard InformationBack Directory
[Chemical Properties]

GREY TO BROWNISH FINE CRYSTALLINE POWDER
[Uses]

See diphenylamine.
[Synthesis]

The synthesis of N,N'-Diphenylbenzidine is as follows:
3.12 g (10mmol) of 4,4'-dibromodiphenyl, 2.3 mL (25 mmol) of aniline, 2.9 g (30 mmol) of t-BuONa, 183 mg (0.2 mmol) of Pd2(dba)3, and 20 mg (0.1 mmol) of P(t-Bu)3 were dissolved in 30 mL of toluene, and then stirred at 90°C for 3 hrs. The reaction mixture was cooled to room temperature and three times extracted with distilled water and diethyl ether. Precipitates in an organic layer were filtered, washed with acetone and diethyl ether, and then dried in vacuum to obtain 0.3g of the intermediate compound C (yield: 90%). synthesis of N,N'-Diphenylbenzidine.png
[Purification Methods]

Crystallise the benzidine from toluene or ethyl acetate. Store it in the dark. [Beilstein 13 H 223, 13 IV 368.]
Spectrum DetailBack Directory
[Spectrum Detail]

N,N'-Diphenylbenzidine(531-91-9)MS
N,N'-Diphenylbenzidine(531-91-9)1HNMR
N,N'-Diphenylbenzidine(531-91-9)13CNMR
N,N'-Diphenylbenzidine(531-91-9)IR1
N,N'-Diphenylbenzidine(531-91-9)IR2
N,N'-Diphenylbenzidine(531-91-9)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

N,N'-Diphenylbenzidine, 97%(531-91-9)
[Alfa Aesar]

N,N'-Diphenylbenzidine, 98%(531-91-9)
[TCI AMERICA]

N,N'-Diphenylbenzidine,>98.0%(LC)(N)(531-91-9)
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