Benzoyl chloride, 4-cyano-2-methoxy- (9CI)

Base Information

• Chemical Name: Benzoyl chloride, 4-cyano-2-methoxy- (9CI)
• CAS No.: 102361-94-4
• Molecular Formula: C9H6 Cl N O2
• Molecular Weight: 195.605
• Mol file: 102361-94-4.mol

Synonyms:2-Methoxy-4-cyanobenzoylchloride; 4-Cyano-2-methoxybenzoyl chloride

Chemical Property of Benzoyl chloride, 4-cyano-2-methoxy- (9CI)

Chemical Property:

• Boiling Point: 338.8±32.0 °C(Predicted)
• PSA: 50.09000
• Density: 1.32±0.1 g/cm3(Predicted)
• LogP: 1.94588

Purity/Quality:

4-Cyano-2-methoxybenzoylchloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzoyl chloride, 4-cyano-2-methoxy- (9CI)

There total 3 articles about Benzoyl chloride, 4-cyano-2-methoxy- (9CI) 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: 100.0%

2-methoxy-4-cyano-benzoic acid (89469-52-3) → 4-Cyano-2-methoxybenzoyl chloride (102361-94-4)

Guidance literature:

With oxalyl dichloride; In dichloromethane; N,N-dimethyl-formamide; for 2h; Inert atmosphere;

DOI:10.1002/ejoc.201600747

Reference yield:

oxalyl dichloride (79-37-8) + 2-methoxy-4-cyano-benzoic acid (89469-52-3) → 4-Cyano-2-methoxybenzoyl chloride (102361-94-4)

Guidance literature:

In 4-(dicyanomethylene)-2-methyl-6-(p-dimethylaminostyryl)-4H-pyran; N,N-dimethyl-formamide;

Reference yield:

4-amino-2-methoxybenzoic acid (2486-80-8) → 4-Cyano-2-methoxybenzoyl chloride (102361-94-4)

Guidance literature:

Multi-step reaction with 2 steps

1: NaNO₂, 2N HCl

2: SOCl₂

With hydrogenchloride; thionyl chloride; sodium nitrite;

DOI:10.1016/S0040-4039(00)85382-4

upstream raw materials:

2-methoxy-4-cyano-benzoic acid

4-amino-2-methoxybenzoic acid

oxalyl dichloride

Downstream raw materials:

N-(3-Amino-pyridin-4-yl)-4-cyano-2-methoxy-benzamide

N-(2-amino-4,5-dichlorophenyl)-2-methoxy-4-cyanobenzamide

2-(4-Carbamoyl-2-methoxyphenyl)-1H-imidazo<4,5-b>pyridine hydrochloride

2-(4-Cyano-2-methoxyphenyl)-1H-imidazo<4,5-b>pyridine hydrochloride

Refernces

• 1、 -. "Azolylbenzamides and analogues and their use for treating osteoporosis". Page/Page column 10. . Retrieved 2010/02/10.
• 2、 -. "Piperazine based inhibitors of factor xa". . . Retrieved 2008/06/13.