Pyridinium, 4-ethyl-1-(2-oxo-2-phenylethyl)-, bromide

Base Information

• Chemical Name: Pyridinium, 4-ethyl-1-(2-oxo-2-phenylethyl)-, bromide
• CAS No.: 16844-13-6
• Molecular Formula: C15H16NO.Br
• Molecular Weight: 306.202
• DSSTox Substance ID: DTXSID80483130

Synonyms:16844-13-6;SCHEMBL6230904;Pyridinium, 4-ethyl-1-(2-oxo-2-phenylethyl)-, bromide;DTXSID80483130;SFLDXMZLXCVULU-UHFFFAOYSA-M;N-(phenacyl)4-ethyl-pyridinium bromide

Chemical Property of Pyridinium, 4-ethyl-1-(2-oxo-2-phenylethyl)-, bromide

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 305.04153
• Heavy Atom Count: 18
• Complexity: 237

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC=[N+](C=C1)CC(=O)C2=CC=CC=C2.[Br-]

Technology Process of Pyridinium, 4-ethyl-1-(2-oxo-2-phenylethyl)-, bromide

There total 2 articles about Pyridinium, 4-ethyl-1-(2-oxo-2-phenylethyl)-, bromide 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:

4-Ethylpyridine (536-75-4,151103-55-8) + α-bromoacetophenone (70-11-1) → N-Phenacyl-4-ethylpyridiniumbromid (16844-13-6)

Guidance literature:

With potassium carbonate; In toluene; at 20 ℃; for 1h;

DOI:10.1021/cc900103r

Reference yield:

→ N-Phenacyl-4-ethylpyridiniumbromid (16844-13-6)

Guidance literature:

4-Ethylpyridin, Phenacylbromid;

Reference yield: 79.0%

Phenylpropargyl aldehyde (2579-22-8) + N-Phenacyl-4-ethylpyridiniumbromid (16844-13-6) → 3-benzoyl-7-ethyl-2-phenylindolizine-1-carbaldehyde

Guidance literature:

With caesium carbonate; In acetonitrile; at 25 ℃; for 12h; Schlenk technique;

DOI:10.1002/ejoc.201600945

upstream raw materials:

4-Ethylpyridine

α-bromoacetophenone

Downstream raw materials:

C₁₇H₁₆N₂OS

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