7-(2-CHLOROPHENYL)-7-OXOHEPTANENITRILE

Base Information

• Chemical Name: 7-(2-CHLOROPHENYL)-7-OXOHEPTANENITRILE
• CAS No.: 898767-80-1
• Molecular Formula: C13H14ClNO
• Molecular Weight: 235.71
• Mol file: 898767-80-1.mol

Synonyms:7-(2-CHLOROPHENYL)-7-OXOHEPTANENITRILE

Chemical Property of 7-(2-CHLOROPHENYL)-7-OXOHEPTANENITRILE

Chemical Property:

• Vapor Pressure: 5.65E-06mmHg at 25°C
• Boiling Point: 379.9°C at 760 mmHg
• Flash Point: 183.6°C
• Density: 1.128g/cm³

Purity/Quality:

97% ^*data from raw suppliers

7-(2-chlorophenyl)-7-oxoheptanenitrile 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 7-(2-CHLOROPHENYL)-7-OXOHEPTANENITRILE

There total 2 articles about 7-(2-CHLOROPHENYL)-7-OXOHEPTANENITRILE 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: 86.0%

1-(2-chlorophenyl)cyclohept-1-ene (100713-43-7) → 7-(2-chlorophenyl)-7-oxoheptanenitrile (898767-80-1)

Guidance literature:

With 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; trimethylsilylazide; oxygen; In acetonitrile; at 95 ℃; for 120h; Schlenk technique;

DOI:10.1021/ja403824y

Reference yield: 76.0%

ethyl (2-chlorobenzoyl)(4-cyanobutyl)acetate (1174527-50-4) → 7-(2-chlorophenyl)-7-oxoheptanenitrile (898767-80-1)

Guidance literature:

With water; sodium hydroxide; In ethanol; at 80 ℃; for 12h; Inert atmosphere;

DOI:10.1016/j.tet.2009.05.004

Reference yield: 57.0%

7-(2-chlorophenyl)-7-oxoheptanenitrile (898767-80-1) → 1-(2-chlorophenyl)-2-cyano-1-cyclohexene (1174527-51-5)

Guidance literature:

With potassium tert-butylate; In tetrahydrofuran; for 5h; Reflux; Inert atmosphere;

DOI:10.1016/j.tet.2009.05.004

upstream raw materials:

ethyl (2-chlorobenzoyl)(4-cyanobutyl)acetate

1-(2-chlorophenyl)cyclohept-1-ene

Downstream raw materials:

1-(2-chlorophenyl)-2-cyano-1-cyclohexene

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