3-Chloro-4-formylbenzonitrile

Base Information

• Chemical Name: 3-Chloro-4-formylbenzonitrile
• CAS No.: 58588-64-0
• Molecular Formula: C8H4ClNO
• Molecular Weight: 165.579
• Hs Code.: 2926909090
• Mol file: 58588-64-0.mol

Synonyms:3-chloro-4-formyl-benzonitrile;S01-0857;3-Chlor-4-formyl-benzonitril;2-chloro-4-cyanobenzaldehyde;

Chemical Property of 3-Chloro-4-formylbenzonitrile

Chemical Property:

• Melting Point: 117-119 °C(Solv: ethanol (64-17-5))
• Boiling Point: 288.8±25.0 °C(Predicted)
• PSA: 40.86000
• Density: 1.32±0.1 g/cm3(Predicted)
• LogP: 2.02418
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C

Purity/Quality:

98% ^*data from raw suppliers

3-Chloro-4-formylbenzonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-Chloro-4-formylbenzonitrile

There total 7 articles about 3-Chloro-4-formylbenzonitrile 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: 89.0%

2-nitropropane (79-46-9) + 4-(bromomethyl)-3-chlorobenzonitrile (21924-83-4) → 3-chloro-4-formyl-benzonitrile (58588-64-0)

Guidance literature:

With ethanol; sodium;

2-nitropropane; 4-(bromomethyl)-3-chlorobenzonitrile;

Reference yield: 89.0%

4-(bromomethyl)-3-chlorobenzonitrile (21924-83-4) → 3-chloro-4-formyl-benzonitrile (58588-64-0)

Guidance literature:

With 2-nitropropane; sodium ethanolate;

DOI:10.1021/jm0612867

Reference yield: 49.0%

4-cyanobenzaldehyde (105-07-7) → 3-chloro-4-formyl-benzonitrile (58588-64-0)

Guidance literature:

With N-chloro-succinimide; palladium diacetate; silver trifluoroacetate; anthranilic acid; trifluoroacetic acid; In 1,2-dichloro-ethane; at 60 ℃; for 24h; Sealed tube;

DOI:10.1021/jacs.6b11188

upstream raw materials:

4-Diacetoxymethyl-3-chlor-benzonitril

4-(bromomethyl)-3-chlorobenzonitrile

3-chloro-4-methylbenzonitrile

2-nitropropane

Downstream raw materials:

2-chloro-4-cyanobenzaldoxime

2-chloro-4-cyanobenzaldehyde chlorooxime

3-(2-chloro-4-cyanophenyl)-5-(4-cyanophenyl)isoxazole

3-(2-chloro-4-cyanophenyl)-5-(3-cyanophenyl)isoxazole

Refernces

• 1、 -. "SUBSTITUTED 4-ARYL-1,4-DIHYDRO-1,6-NAPHTHYRIDINAMIDES AND USE THEREOF". . . Retrieved 2016/10/17.
• 2、 -. "SUBSTITUTED 4-ARYL-1,4-DIHYDRO-1,6-NAPHTHYRIDINES AND USE THEREOF". Page/Page column 24. . Retrieved 2010/12/29.