4-Nitro-1-oxido-2-pyridin-2-ylpyridin-1-ium

Base Information

• Chemical Name: 4-Nitro-1-oxido-2-pyridin-2-ylpyridin-1-ium
• CAS No.: 14163-00-9
• Molecular Formula: C10H7N3O3
• Molecular Weight: 217.184
• Hs Code.: 2933399090
• European Community (EC) Number: 663-002-6
• DSSTox Substance ID: DTXSID10391532
• Wikidata: Q72494533
• Mol file: 14163-00-9.mol

Synonyms:14163-00-9;4-Nitro-[2,2'-bipyridine] 1-oxide;4-nitro-1-oxido-2-pyridin-2-ylpyridin-1-ium;4-NITRO-2,2'-BIPYRIDINE-N-OXIDE;2,2'-Bipyridine, 4-nitro-, 1-oxide;4-NITRO-2,2/'-BIPYRIDINE-N-OXIDE;SCHEMBL308654;DTXSID10391532;TXORGAZSDCKPSN-UHFFFAOYSA-N;4-nitro-2,2'-bipyridyl-N-oxide;4-nitro-2,2' -bipyridyl-N-oxide;BCP27353;4-Nitro-[2,2'-bipyridine]1-oxide;4-Nitro-[2,2']bipyridinyl 1-oxide;AKOS015951059;4-nitro-2-(2-pyridinyl)pyridine-N oxide;4-nitro-2-(pyridin-2-yl)pyridine 1-oxide;J-400640;4-Nitro-1-oxo-2-(pyridin-2-yl)-1lambda~5~-pyridine

Chemical Property of 4-Nitro-1-oxido-2-pyridin-2-ylpyridin-1-ium

Chemical Property:

• Vapor Pressure: 6.48E-10mmHg at 25°C
• Melting Point: 180-184℃
• Boiling Point: 507.4oC at 760 mmHg
• Flash Point: 260.6oC
• PSA: 84.17000
• Density: 1.4g/cm3
• LogP: 2.60850
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 217.04874109
• Heavy Atom Count: 16
• Complexity: 256

Purity/Quality:

97% ^*data from raw suppliers

4-NITRO-2,2'-BIPYRIDINE-N-OXIDE Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-Nitro-1-oxido-2-pyridin-2-ylpyridin-1-ium

There total 9 articles about 4-Nitro-1-oxido-2-pyridin-2-ylpyridin-1-ium 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: 90.0%

2,2'-bipyridyl N-oxide (33421-43-1) → 4-nitro-2,2'-bipyridine N-oxide (14163-00-9)

Guidance literature:

With sulfuric acid; potassium nitrate; at 80 ℃; for 30h;

DOI:10.2478/s11696-012-0196-5

Reference yield: 42.0%

2-bromo-pyridine (109-04-6) + 4-nitraminopyridine N-oxide (1124-33-0) → 4-nitro-2,2'-bipyridine N-oxide (14163-00-9)

Guidance literature:

With tri-tert-butyl phosphine; palladium diacetate; potassium carbonate; In toluene; at 120 ℃; for 24h; Inert atmosphere;

DOI:10.1021/ol200565u

Reference yield: 40.0%

4-nitro-(2,2'-bipyridine) (14162-93-7) → 4,4'-dinitro-2,2'-bipyridine (18511-72-3) + 4-nitro-2,2'-bipyridine N-oxide (14163-00-9)

Guidance literature:

With dihydrogen peroxide; In acetic acid; at 70 ℃; Title compound not separated from byproducts;

upstream raw materials:

2,2'-bipyridyl N-oxide

4-nitro-(2,2'-bipyridine)

[2,2]bipyridinyl

2-bromo-pyridine

Downstream raw materials:

4-bromo-2,2’-bipyridine N-oxide

4-bromo-2,2'-bipyridyl

2,2'-bipyridine-4-carboxaldehyde

3-(2,2'-bipyridin-4-yl)prop-2-yn-1-ol