Benzonitrile, 2-amino-5-(2-methyl-1H-imidazol-1-yl)-

Base Information

• Chemical Name: Benzonitrile, 2-amino-5-(2-methyl-1H-imidazol-1-yl)-
• CAS No.: 754193-59-4
• Molecular Formula: C11H10N4
• Molecular Weight: 198.227

Synonyms:2-Amino-5-(2-methyl-imidazol-1-yl)-benzonitrile;4-(2-methyl-1H-imidazol-1-yl)-2-cyanoaniline;

Chemical Property of Benzonitrile, 2-amino-5-(2-methyl-1H-imidazol-1-yl)-

Chemical Property:

• Boiling Point: 441.6±55.0 °C(Predicted)
• PSA: 67.63000
• Density: 1.23±0.1 g/cm3(Predicted)
• LogP: 2.21578

Purity/Quality:

2-amino-5-(2-methyl-1H-imidazol-1-yl)-Benzonitrile 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzonitrile, 2-amino-5-(2-methyl-1H-imidazol-1-yl)-

There total 3 articles about Benzonitrile, 2-amino-5-(2-methyl-1H-imidazol-1-yl)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.0%

5-(2-methylimidazol-1-yl)-2-nitrobenzonitrile (179552-68-2) → 2-amino-5-(2-methylimidazol-1-yl)benzonitrile (754193-59-4)

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol; for 3h; under 2430.6 Torr;

DOI:10.1021/jm0497949

Reference yield:

5-fluoro-2-nitrobenzonitrile (50594-78-0) → 2-amino-5-(2-methylimidazol-1-yl)benzonitrile (754193-59-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 96 percent / acetonitrile / 12 h / Heating

2: 98 percent / H₂ / Pd/C / methanol / 3 h / 2430.6 Torr

With hydrogen; palladium on activated charcoal; In methanol; acetonitrile;

DOI:10.1021/jm0497949

Reference yield:

2,4-Difluoronitrobenzene (446-35-5) → 2-amino-5-(2-methylimidazol-1-yl)benzonitrile (754193-59-4)

Guidance literature:

Multi-step reaction with 3 steps

1: 31 percent / dimethylformamide / 12 h / 20 °C

2: 96 percent / acetonitrile / 12 h / Heating

3: 98 percent / H₂ / Pd/C / methanol / 3 h / 2430.6 Torr

With hydrogen; palladium on activated charcoal; In methanol; N,N-dimethyl-formamide; acetonitrile;

DOI:10.1021/jm0497949

upstream raw materials:

5-(2-methylimidazol-1-yl)-2-nitrobenzonitrile

2,4-Difluoronitrobenzene

5-fluoro-2-nitrobenzonitrile

Downstream raw materials:

2-(3-cyano-4-fluoro-phenyl)-5-trifluoromethyl-2H-pyrazole-3-carboxylic acid [2-cyano-4-(2-methyl-imidazol-1-yl)-phenyl]-amide

[6-(2-methyl-1H-imidazol-1-yl)-2-phenyl]quinazoline

4-(2-methyl-1H-imidazol-1-yl)-2-aminomethylaniline

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