N-(6-Chloro-3-pyridinyl)-Na(2)-cyanoguanidine

Base Information

• Chemical Name: N-(6-Chloro-3-pyridinyl)-Na(2)-cyanoguanidine
• CAS No.: 323588-82-5
• Molecular Formula: C₇H₆ClN₅
• Molecular Weight: 195.611
• DSSTox Substance ID: DTXSID001264534
• Mol file: 323588-82-5.mol

Synonyms:SCHEMBL4683458;DTXSID001264534;323588-82-5;N-(6-Chloro-3-pyridinyl)-Na(2)-cyanoguanidine

Chemical Property of N-(6-Chloro-3-pyridinyl)-Na(2)-cyanoguanidine

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 195.0311729
• Heavy Atom Count: 13
• Complexity: 243

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=NC=C1N=C(N)NC#N)Cl

Technology Process of N-(6-Chloro-3-pyridinyl)-Na(2)-cyanoguanidine

There total 1 articles about N-(6-Chloro-3-pyridinyl)-Na(2)-cyanoguanidine 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: 86.0%

6-Chloro-pyridin-3-ylamine (5350-93-6) + sodium dicyanamide (1934-75-4) → N-(6-chloropyridin-3-yl)-N'-cyanoguanidine (323588-82-5,960502-22-1)

Guidance literature:

With hydrogenchloride; In water; at 45 ℃; for 4h;

DOI:10.1021/jm7010194

Reference yield: 39.0%

N-(6-chloropyridin-3-yl)-N'-cyanoguanidine (323588-82-5,960502-22-1) + N-[1-(1H-1,2,3-benzotriazol-1-yl)-2,2-dichloropropyl]-4-chlorobenzamide (323591-08-8) → 4-chloro-N-{2,2-dichloro-1-[N'-(6-chloropyridin-3-yl)-N''-cyanoguanidino]propyl}benzamide

Guidance literature:

With caesium carbonate; In acetonitrile; at 20 ℃; for 12h;

DOI:10.1021/jm7010194

Reference yield:

N-(6-chloropyridin-3-yl)-N'-cyanoguanidine (323588-82-5,960502-22-1) + N-[1-(1H-1,2,3-benzotriazol-1-yl)-2,2-dichloropropyl]-3-chlorobenzamide (323591-16-8) → 3-chloro-N-{2,2-dichloro-1-[N'-(6-chloropyridin-3-yl)-N''-cyanoguanidino]propyl}benzamide

Guidance literature:

With caesium carbonate; In acetonitrile; at 20 ℃; for 12h;

DOI:10.1021/jm7010194

upstream raw materials:

6-Chloro-pyridin-3-ylamine

sodium dicyanamide

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