3-Cyano-1,4-dimethylpyridin-1-ium iodide

Base Information

• Chemical Name: 3-Cyano-1,4-dimethylpyridin-1-ium iodide
• CAS No.: 61327-46-6
• Molecular Formula: C8H9N2.I
• Molecular Weight: 260.077
• DSSTox Substance ID: DTXSID30492217

Synonyms:3-Cyano-1,4-dimethylpyridin-1-ium iodide;61327-46-6;SCHEMBL12491791;DTXSID30492217;3-Cyano-1,4-dimethylpyridin-1-iumiodide;1,4-dimethylpyridin-1-ium-3-carbonitrile;iodide

Chemical Property of 3-Cyano-1,4-dimethylpyridin-1-ium iodide

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 259.98105
• Heavy Atom Count: 11
• Complexity: 156

Purity/Quality:

95+% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=[N+](C=C1)C)C#N.[I-]

Technology Process of 3-Cyano-1,4-dimethylpyridin-1-ium iodide

There total 1 articles about 3-Cyano-1,4-dimethylpyridin-1-ium iodide 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: 82.0%

3-cyano-4-methylpyridine (5444-01-9) + methyl iodide (74-88-4) → 3-cyano-1,4-dimethylpyridinium iodide (61327-46-6)

Guidance literature:

In diethyl ether; acetone; at 20 ℃; for 96h;

DOI:10.1021/jo001407p

Reference yield: 63.0%

3-cyano-1,4-dimethylpyridinium iodide (61327-46-6) → 1,4-dimethyl-1,4-dihydropyridine-3-carbonitrile (331980-32-6)

Guidance literature:

With sodium dithionite; sodium hydrogencarbonate; In methanol; water; at 20 ℃; for 24h;

DOI:10.1021/jo001407p

Reference yield: 50.0%

3,5-diformyl-4-hydroxybenzoic acid ethyl ester (329904-04-3) + 3-cyano-1,4-dimethylpyridinium iodide (61327-46-6) → C27H24N4O3(2+)*2I(1-)

Guidance literature:

With piperidine; In ethanol; at 80 ℃; for 0.5h; Inert atmosphere;

DOI:10.1021/ja308124q

upstream raw materials:

3-cyano-4-methylpyridine

methyl iodide

Downstream raw materials:

1,4-dimethyl-1,4-dihydropyridine-3-carbonitrile

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