Benzoyl chloride, 4-(1H-pyrrol-1-yl)- (9CI)

Base Information

• Chemical Name: Benzoyl chloride, 4-(1H-pyrrol-1-yl)- (9CI)
• CAS No.: 220769-82-4
• Molecular Formula: C₁₁H₈ClNO
• Molecular Weight: 205.644
• Mol file: 220769-82-4.mol

Synonyms:4-Pyrrol-1-ylbenzoylchloride

Chemical Property of Benzoyl chloride, 4-(1H-pyrrol-1-yl)- (9CI)

Chemical Property:

• PSA: 22.00000
• LogP: 2.85630

Purity/Quality:

4-(1H-Pyrrol-1-yl)benzoylchloride 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzoyl chloride, 4-(1H-pyrrol-1-yl)- (9CI)

There total 2 articles about Benzoyl chloride, 4-(1H-pyrrol-1-yl)- (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: 60.0%

4-(1H-pyrrole-1-yl)benzoic acid (22106-33-8) → 4-(1H-pyrrol-1-yl)benzoyl chloride (220769-82-4)

Guidance literature:

With thionyl chloride; In N,N-dimethyl-formamide; at 40 ℃; for 0.5h;

Reference yield:

4-amino-benzoic acid (150-13-0,159246-81-8,8014-65-1) → 4-(1H-pyrrol-1-yl)benzoyl chloride (220769-82-4)

Guidance literature:

Multi-step reaction with 2 steps

1: acetic acid / 0.5 h / Reflux

2: thionyl chloride / N,N-dimethyl-formamide / 0.5 h / 40 °C

With thionyl chloride; acetic acid; In N,N-dimethyl-formamide;

Reference yield:

4-(1H-pyrrol-1-yl)benzoyl chloride (220769-82-4) + 4-amino-5-[2,4-bis(benzyloxy)-5-isopropylphenyl]isoxazole-3-carboxylic acid ethylamide (1202920-72-6) → C40H38N4O5

Guidance literature:

With triethylamine; In dichloromethane; for 5h; Inert atmosphere;

DOI:10.1021/jm201155e

upstream raw materials:

4-amino-benzoic acid

4-(1H-pyrrole-1-yl)benzoic acid

Downstream raw materials:

5-(2,4-dihydroxy-5-isopropylphenyl)-4-(4-pyrrolidin-1-ylbenzoylamino)isoxazole-3-carboxylic acid ethylamide

Refernces