N-(4-cyanophenyl)nicotinamide

Base Information

• Chemical Name: N-(4-cyanophenyl)nicotinamide
• CAS No.: 875108-70-6
• Molecular Formula: C₁₃H₉N₃O
• Molecular Weight: 223.234
• Mol file: 875108-70-6.mol

Synonyms:N-(4-cyanophenyl)-3-pyridinecarboxamide

Chemical Property of N-(4-cyanophenyl)nicotinamide

Chemical Property:

• Melting Point: 200-201 °C(Solv: ethanol (64-17-5))
• Boiling Point: 335.0±22.0 °C(Predicted)
• PKA: 11.25±0.70(Predicted)
• Density: 1.28±0.1 g/cm3(Predicted)

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of N-(4-cyanophenyl)nicotinamide

There total 4 articles about N-(4-cyanophenyl)nicotinamide 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: 64.0%

3-Bromopyridine (626-55-1,163928-56-1) + 4-Aminobenzonitrile (873-74-5) + molybdenum hexacarbonyl (13939-06-5,199620-15-0) → N-(4-cyanophenyl)-3-pyridinecarboxamide (875108-70-6)

Guidance literature:

With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; 1,8-diazabicyclo[5.4.0]undec-7-ene; In N,N-dimethyl-formamide; at 120 ℃; for 3h; Sealed tube; Inert atmosphere;

DOI:10.1055/s-0037-1609152

Reference yield:

4-bromobenzenecarbonitrile (623-00-7) + nicotinamide (98-92-0,1255150-40-3) → N-(4-cyanophenyl)-3-pyridinecarboxamide (875108-70-6) + 4-Aminobenzonitrile (873-74-5)

Guidance literature:

With dichlorobis(tri-O-tolylphosphine)palladium; caesium carbonate; 2,2'-bis-(diphenylphosphino)-1,1'-binaphthyl; at 150 ℃; for 6h; Inert atmosphere;

DOI:10.1016/j.tet.2009.01.033

Reference yield:

4-Cyanochlorobenzene (623-03-0) + nicotinamide (98-92-0,1255150-40-3) → N-(4-cyanophenyl)-3-pyridinecarboxamide (875108-70-6)

Guidance literature:

With C₃₃H₃₇N₄P; potassium carbonate; bis(dibenzylideneacetone)-palladium⁽⁰⁾; In tert-butyl alcohol; at 95 ℃; for 3h; Inert atmosphere; Sonication;

upstream raw materials:

4-bromobenzenecarbonitrile

nicotinamide

3-Bromopyridine

4-Aminobenzonitrile