76889-76-4

Basic information

• Product Name: 2-(1H-BENZIMIDAZOL-2-YL)BENZONITRILE
• Synonyms: 2-(1H-BENZIMIDAZOL-2-YL)BENZONITRILE;2-(1H-Benzo[d]imidazol-2-yl)benzonitrile
• CAS NO: 76889-76-4
• Molecular Formula: C₁₄H₉N₃
• Molecular Weight: 219.24
• Mol File: 76889-76-4.mol
• Article Data: 11

Chemical Properties

• Boiling Point: 483.9±47.0 °C(Predicted)
• Appearance: /
• Density: 1.31±0.1 g/cm3(Predicted)
• PKA: 11.03±0.10(Predicted)
• CAS DataBase Reference: 2-(1H-BENZIMIDAZOL-2-YL)BENZONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(1H-BENZIMIDAZOL-2-YL)BENZONITRILE(76889-76-4)
• EPA Substance Registry System: 2-(1H-BENZIMIDAZOL-2-YL)BENZONITRILE(76889-76-4)

Safety Data

• HazardClass: 6.1
• Hazardous Substances Data: 76889-76-4(Hazardous Substances Data)

Usage

Type of compound

Benzimidazole derivative

Common use

Building block in the synthesis of various pharmaceuticals and organic compounds

Medicinal chemistry interest

Potential biological activities, including enzyme inhibition and modulation of cellular processes

Studied properties

Potential antifungal and antiproliferative properties

Physical state at room temperature

Solid

Handling and storage

Standard laboratory conditions are typically used.

Upstream product

• 76889-75-3 N-[3-Imino-2,3-dihydro-isoindol-(1Z)-ylidene]-benzene-1,2-diamine 
• 27611-63-8 2-Cyanobenzoyl chloride 
• 95-54-5 1,2-diamino-benzene 
• 91-15-6 phthalonitrile 
• 7468-67-9 o-formylbenzonitrile 
• 1042161-45-4 (E)-2-azido-N-(2-cyanobenzylidene)aniline 
• 1608149-17-2 2-(((2-aminophenyl)amino)methyl)benzonitrile 
• 22115-41-9 2-(bromomethyl)benzonitrile 
• 716-79-0 2-phenyl-1H-benzoimidazole 
• 874-77-1 2-(4-methylpiperazin-1-yl)acetonitrile 
• 3010-02-4 diethylaminoacetonitrile 
• 29134-29-0 N-cyanomethyl pyrrolidine 
• 3010-03-5 piperidin-1-yl-acetonitrile 

Downstream Products

• 16529-06-9 2-(2-carboxyphenyl)benzimidazole 
• 2717-05-7 1,2-benzoylenebenzimidazole 

Relevant articles and documents

One-Pot Synthesis of Benzo[4,5]imidazo[2,1-a]isoquinolines and Isoquinolino[3,4-b]quinoxalines via Tandem Cyclization Strategies

Two operationally simple one-pot protocols have been developed for the synthesis of amino-functionalized benzo[4,5]imidazo[2,1-a]isoquinolines and isoquinolino[3,4-b]quinoxalines. Optimization data and substrate scope for these atom-economical transformat

Solid Phase Synthesis of Biologically active Benzimidazole Derivatives Catalysed by CH3S03H-Si02 under Solvent free Condition

A simple an expeditious method was established for the synthesis of 2-Substituted-1H-Benzimidazole derivatives at 90°C using o-phenylenediamine and different aldehydes. It has been found that a mixture of Methanesulphonic acid-Si02to be an effective catal

Cu(OAc)2-Mediated benzimidazole-directed C-H cyanation using 2-(4-methylpiperazin-1-yl)acetonitrile as the cyano source

A new protocol for the Cu(OAc)2-mediated cyanation of arenes using benzimidazole as the directing group with 2-(4-methylpiperazin-1-yl)acetonitrile as the cyano source was developed. A series of cyano derivatives were facilely and conveniently obtained in moderate to good yields by using this method. The C-H activation catalytic system was originally applied to the C(sp2)-H cyanation of the aryl/heteroaryl to synthesize 2-(1H-benzo[d]imidazol-2-yl)aryl nitriles. There were 19 new compounds in the synthesized 20 cyanide products. In this reaction, 2-(4-methylpiperazin-1-yl)acetonitrile as the cyano source was originally employed in the C(sp2)-H cyanation of the arenes. In addition, a fluorescent material 5a was obtained by derivative reactions of the obtained cyanide product 3.