ChemicalBook--->CAS DataBase List--->25078-04-0

25078-04-0

25078-04-0 Structure

25078-04-0 Structure
IdentificationBack Directory
[Name]

2,4-Dimethyldiphenylamine
[CAS]

25078-04-0
[Synonyms]

N-PHENYL-2,4-XYLIDINE
PHENYL(2,4-XYLYL)AMINE
2,4-DIMETHYLDIPHENYLAMINE
2,4-DiMethyl-N-phenylaniline
2,4-DiMethyl-N-phenylbenzenaMine
N-Phenyl-2,4-xylidine Phenyl(2,4-xylyl)amine
TRIS(4-BROMOPHENYL)2,4-DIMETHYL DIPHENYLAMINE
[EINECS(EC#)]

677-190-2
[Molecular Formula]

C14H15N
[MDL Number]

MFCD08275461
[MOL File]

25078-04-0.mol
[Molecular Weight]

197.28
Chemical PropertiesBack Directory
[Melting point ]

43°C
[Boiling point ]

170°C 3mm
[density ]

1.049±0.06 g/cm3(Predicted)
[Fp ]

0°C
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[solubility ]

soluble in Methanol
[form ]

powder to lump
[pka]

1.11±0.40(Predicted)
[color ]

White to Yellow
[InChI]

InChI=1S/C14H15N/c1-11-8-9-14(12(2)10-11)15-13-6-4-3-5-7-13/h3-10,15H,1-2H3
[InChIKey]

BWYYRZBQXLCZJL-UHFFFAOYSA-N
[SMILES]

C1(NC2=CC=CC=C2)=CC=C(C)C=C1C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
[Risk Statements ]

20/21/22-36/37/38
[Safety Statements ]

22-26-36/37/39
[HS Code ]

2921.49.5000
Hazard InformationBack Directory
[Chemical Properties]

white crystalline.
[Uses]

2,4-Dimethyldiphenylamine is mainly used in organic synthesis and pharmaceutical intermediates.
[Synthesis]

Chlorobenzene

108-90-7

2,4-Dimethyl aniline

95-68-1

2,4-Dimethyldiphenylamine

25078-04-0

GENERAL STEPS: A solution of potassium tert-butoxide (KOtBu, 102.1 mg, 1.3 eq.) and complex 3a (10-50 mL, 0.01-0.05 mol, prepared from 4.6 mg of complex 3a dissolved in 1.0 mL of dichloromethane) was added to a Schlenk reaction tube under nitrogen atmosphere. The reaction tube was sealed and the solvent was removed under reduced pressure. Toluene (0.5 mL), 2,4-dimethylaniline (0.84 mmol) and chlorobenzene (0.70 mmol) were then added sequentially. The reaction mixture was stirred vigorously at the indicated temperature for 3 to 24 hours. Upon completion of the reaction, the solvent was removed under reduced pressure and the residue was purified by silica gel column chromatography to afford the target product 2,4-dimethyldiphenylamine.

[References]

[1] Advanced Synthesis and Catalysis, 2008, vol. 350, # 5, p. 652 - 656
[2] Tetrahedron, 2017, vol. 73, # 52, p. 7308 - 7314
Spectrum DetailBack Directory
[Spectrum Detail]

2,4-Dimethyldiphenylamine(25078-04-0)MS
2,4-Dimethyldiphenylamine(25078-04-0)1HNMR
2,4-Dimethyldiphenylamine(25078-04-0)13CNMR
2,4-Dimethyldiphenylamine(25078-04-0)IR1
2,4-Dimethyldiphenylamine(25078-04-0)IR2
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