2-(4-chlorophenyl)-3-phenylpropanenitrile

Base Information

• Chemical Name: 2-(4-chlorophenyl)-3-phenylpropanenitrile
• CAS No.: 5681-31-2
• Molecular Formula: C15H12ClN
• Molecular Weight: 241.72
• Mol file: 5681-31-2.mol

Synonyms:

Chemical Property of 2-(4-chlorophenyl)-3-phenylpropanenitrile

Chemical Property:

• Vapor Pressure: 1.67E-05mmHg at 25°C
• Boiling Point: 364.6°Cat760mmHg
• Flash Point: 145.6°C
• Density: 1.176g/cm³

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 2-(4-chlorophenyl)-3-phenylpropanenitrile

There total 5 articles about 2-(4-chlorophenyl)-3-phenylpropanenitrile 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: 99.0%

(Z)-2-(4-chlorophenyl)-3-phenylacrylonitrile (6269-09-6) → 2-(4-chlorophenyl)-3-phenylpropanenitrile (5681-31-2)

Guidance literature:

With formic acid; triethylamine; (R,R)-N-(p-toluenesulfonyl)-1,2-diphenylethylenediamine; [ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂; In dichloromethane; at 30 ℃; for 13h;

DOI:10.1021/jo0478205

Reference yield: 95.0%

benzyl alcohol (100-51-6,185532-71-2) + p-chlorobenzyl cyanide (140-53-4) → 2-(4-chlorophenyl)-3-phenylpropanenitrile (5681-31-2)

Guidance literature:

With potassium tert-butylate; C₃₅H₂₇Cl₂N₄PRuS; In toluene; at 135 ℃; for 1h; Inert atmosphere; Schlenk technique;

DOI:10.1002/aoc.5451

Reference yield: 80.0%

→ 2-(4-chlorophenyl)-3-phenylpropanenitrile (5681-31-2)

Guidance literature:

With C₄₉H₃₈Cl₂N₅O₄PRuS; potassium hydroxide; In toluene; at 140 ℃; for 4h; Inert atmosphere;

upstream raw materials:

(Z)-2-(4-chlorophenyl)-3-phenylacrylonitrile

benzyl alcohol

p-chlorobenzyl cyanide

α-(p-chlorophenyl)-β-phenylacrylonitrile

Downstream raw materials:

4'-chloro-2-phenylacetophenone