4-(4-OXOCYCLOHEXYL)BENZONITRILE

Base Information

• Chemical Name: 4-(4-OXOCYCLOHEXYL)BENZONITRILE
• CAS No.: 73204-07-6
• Molecular Formula: C13H13 N O
• Molecular Weight: 199.252
• Hs Code.: 2926909090
• Mol file: 73204-07-6.mol

Synonyms:4-(p-Cyanophenyl)cyclohexanone

Chemical Property of 4-(4-OXOCYCLOHEXYL)BENZONITRILE

Chemical Property:

• Vapor Pressure: 1.38E-05mmHg at 25°C
• Refractive Index: 1.557
• Boiling Point: 367.3°C at 760 mmHg
• Flash Point: 176°C
• PSA: 40.86000
• Density: 1.12g/cm³
• LogP: 2.78498
• Storage Temp.: Sealed in dry,Room Temperature

Purity/Quality:

99%, ^*data from raw suppliers

4-(4-Oxocyclohexyl)benzonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-(4-OXOCYCLOHEXYL)BENZONITRILE

There total 6 articles about 4-(4-OXOCYCLOHEXYL)BENZONITRILE 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: 16.0%

4-(4-oxocyclohexyl)benzamide (73204-06-5) → 4-(4-cyanophenyl)cyclohexanone (73204-07-6)

Guidance literature:

With pyridine; pivaloyl chloride; In dichloromethane; at 20 ℃;

Reference yield:

4-(4-oxocyclohexyl)phenyl trifluoromethanesulfonate (155098-65-0) → 4-(4-cyanophenyl)cyclohexanone (73204-07-6)

Guidance literature:

dicyanozinc; 1,1'-bis-(diphenylphosphino)ferrocene; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; for 0.166667h;

4-(4-oxocyclohexyl)phenyl trifluoromethanesulfonate; In N,N-dimethyl-formamide; at 120 ℃; Product distribution / selectivity;

Reference yield:

4-(4-cyanophenyl)cyclohexanone-ethylene ketal (149507-27-7) + pyridinium p-toluenesulfonate (24057-28-1) → 4-(4-cyanophenyl)cyclohexanone (73204-07-6)

Guidance literature:

In tert-butyl methyl ether; water; ethyl acetate; acetone;

upstream raw materials:

4-(4-cyanophenyl)cyclohexanone-ethylene ketal

pyridinium p-toluenesulfonate

4-(4-oxocyclohexyl)phenyl trifluoromethanesulfonate

4-(4-oxocyclohexyl)benzamide

Downstream raw materials:

4-(4-cyanophenyl)cyclohexanone-ethylene ketal

Refernces

• 1、 -. "4-AZETIDINYL-1-PHENYL-CYCLOHEXANE ANTAGONISTS OF CCR2". Page/Page column 62. . Retrieved 2010/11/03.
• 2、 -. "Benzamide derivatives and uses related thereto". Page/Page column 54-55. . Retrieved 2008/06/13.