133909-96-3

Basic information

• Product Name: 3-(4-Methylphenyl)benzonitrile
• Synonyms: 3-(4-Methylphenyl)benzonitrile;4'-methyl-biphenyl-3-carbonitrile
• CAS NO: 133909-96-3
• Molecular Formula: C₁₄H₁₁N
• Molecular Weight: 193.24384
• Mol File: 133909-96-3.mol
• Article Data: 32

Chemical Properties

• Melting Point: 74-75 °C
• Boiling Point: 338.0±21.0 °C(Predicted)
• Appearance: /
• Density: 1.09±0.1 g/cm3(Predicted)
• Storage Temp.: 2-8°C
• CAS DataBase Reference: 3-(4-Methylphenyl)benzonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(4-Methylphenyl)benzonitrile(133909-96-3)
• EPA Substance Registry System: 3-(4-Methylphenyl)benzonitrile(133909-96-3)

Safety Data

• Hazardous Substances Data: 133909-96-3(Hazardous Substances Data)

Upstream product

• 6952-59-6 3-cyanobromobenzene 
• 106-43-4 para-chlorotoluene 
• 1235553-97-5 naphthalen-2-yl 4-methylbenzene-1-sulfonate 
• 66152-74-7 3-<(trifluoromethanesulfonyl)oxy>benzonitrile 
• 5142-75-6 tri(p-tolyl)bismuth 
• 192887-48-2 p-MeC₆H₄-MnCl 
• 585-76-2 m-bromobenzoic acid 
• 5720-05-8 4-methylphenylboronic acid 
• 106-38-7 para-bromotoluene 
• 150255-96-2 (3‐cyanophenyl)boronic acid 
• 100-47-0 benzonitrile 
• 108-88-3 toluene 
• 1877-72-1 3-Cyanobenzoic acid 
• 766-84-7 3-chloro-benzonitrile 

Downstream Products

• 1184915-89-6 5-(4'-methyl-biphenyl-3-yl)-1-trityl-1H-tetrazole 
• 1429045-90-8 C₂₅H₂₂N₆S 
• 1429045-87-3 C₂₃H₁₈N₆S 
• 1429045-85-1 C₂₂H₁₆N₆S 
• 644-08-6 4-Methylbiphenyl 
• 1417334-85-0 C₂₁H₁₄N₄OS 
• 1417334-74-7 C₂₃H₁₅N₃O₃S 
• 1417334-67-8 C₂₄H₁₇N₃O₃S 
• 544694-57-7 4-{4-[(3'-carbamimidoyl-biphenyl-4-ylmethyl)-methanesulfonyl-amino]-phenoxy}-piperidine-1-carboxylic acid tert-butyl ester 

Relevant articles and documents

Convenient and efficient Suzuki-Miyaura cross-coupling catalyzed by a palladium/diazabutadiene system

(matrix presented) A Pd(OAc)2/diazabutadiene system has been developed for the catalytic cross-coupling of aryl halides with arylboronic acids. A combination of the diazabutadiene DAB-Cy (1, N,N′-dicyclohexyl-1,4-dizabutadiene) and Pd(OAc)2 was found to form an excellent catalyst for the Suzuki-Miyaura cross-coupling of various aryl bromides and activated aryl chlorides with arylboronic acids.

Amide-ligand-controlled highly para-selective arylation of monosubstituted simple arenes with arylboronic acids

Pd-catalyzed highly para-selective arylations of monosubstituted simple arenes with arylboronic acids to widely existed biaryls have been developed. Inspired by requisite amide-directing groups in reported selective oxidative couplings, amide ligands, especially DMF, are designed and found to be critical for the selectivity control in current arylations.

A cross-coupling synthesis of functionalised biaryls using Knochel-type organozinc reagents and a pyridine enhanced palladium catalyst

A variety of functionalised biaryls were synthesised on the 20-30 mmol scale by using Knochel type organozinc reagents (organozinc reagents prepared from aryl halides, Zn powder and LiCl) catalysed by PEPPSI (a pyridine enhanced palladium catalyst). The protocol enabled the Negishi reactions to proceed in a smooth, rapid and mild way to give the corresponding products in excellent yields (80 ～ 96%). Sensitive functional groups, such as CN and COOEt groups, were tolerated in the coupling reaction.