BUTTPARK 52\04-72

Base Information

• Chemical Name: BUTTPARK 52\04-72
• CAS No.: 851202-94-3
• Molecular Formula: C₁₂H₁₂N₂O
• Molecular Weight: 200.24
• Mol file: 851202-94-3.mol

Synonyms:6-QUINOLINECARBONITRILE, 1-ACETYL-1,2,3,4-TETRAHYDRO-;1-Acetyl-1,2,3,4-tetrahydroquinoline-6-carbonitrile;

Chemical Property of BUTTPARK 52\04-72

Chemical Property:

• Vapor Pressure: 1.43E-08mmHg at 25°C
• Boiling Point: 458.0±45.0 °C(Predicted)
• PKA: -2.34±0.20(Predicted)
• PSA: 44.10000
• Density: 1.20±0.1 g/cm3(Predicted)
• LogP: 1.92238

Purity/Quality:

97% ^*data from raw suppliers

1-Acetyl-1,2,3,4-tetrahydroquinoline-6-carbonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of BUTTPARK 52\04-72

There total 2 articles about BUTTPARK 52\04-72 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: 53.0%

1-(6-bromo-1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one (22190-40-5) → 1-acetyl-1,2,3,4-tetrahydroquinoline-6-carbonitrile (851202-94-3)

Guidance literature:

1-(6-bromo-1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one; With copper(I) cyanide; In DMF (N,N-dimethyl-formamide); for 18h; Heating / reflux;

With ammonia; In DMF (N,N-dimethyl-formamide); water;

Reference yield:

→ 1-acetyl-1,2,3,4-tetrahydroquinoline-6-carbonitrile (851202-94-3)

Guidance literature:

With 1,1'-bis-(diphenylphosphino)ferrocene; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; zinc diacetate; zinc; In N,N-dimethyl-formamide; at 100 ℃; for 3.5h; Inert atmosphere;

Reference yield: 61.0%

1-acetyl-1,2,3,4-tetrahydroquinoline-6-carbonitrile (851202-94-3) → 1,2,3,4-tetrahydroquinoline-6-carboxylic acid (5382-49-0)

Guidance literature:

With hydrogenchloride; water; for 18h; Heating / reflux;

upstream raw materials:

1-(6-bromo-1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one

Downstream raw materials:

1,2,3,4-tetrahydroquinoline-6-carboxylic acid

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