4'-Nitro-2,2'-bipyridine-N-oxide

Base Information

• Chemical Name: 4'-Nitro-2,2'-bipyridine-N-oxide
• CAS No.: 84175-05-3
• Molecular Formula: C10H7N3O3
• Molecular Weight: 217.18
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID80400029
• Wikidata: Q82202840
• Mol file: 84175-05-3.mol

Synonyms:4'-NITRO-2,2'-BIPYRIDINE-N-OXIDE;84175-05-3;4-nitro-2-(1-oxidopyridin-1-ium-2-yl)pyridine;4'-Nitro-[2,2'-bipyridine] 1-oxide;DTXSID80400029;AKOS024325232;4'-Nitro-[2,2'-bipyridine]1-oxide

Chemical Property of 4'-Nitro-2,2'-bipyridine-N-oxide

Chemical Property:

• Vapor Pressure: 6.48E-10mmHg at 25°C
• Boiling Point: 507.4°C at 760 mmHg
• Flash Point: 260.6°C
• 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:

99.0% ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4'-Nitro-2,2'-bipyridine-N-oxide

There total 3 articles about 4'-Nitro-2,2'-bipyridine-N-oxide 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: 40.0%

2,2'-bipyridyl N-oxide (33421-43-1) → 4'-nitro-2,2'-bipyridine-N-oxide (84175-05-3)

Guidance literature:

With sulfuric acid; nitric acid; at 110 ℃; for 5.25h; Inert atmosphere;

DOI:10.1039/c9nj01632e

Reference yield: 5.8%

4-nitro-(2,2'-bipyridine) (14162-93-7) → 4'-nitro-2,2'-bipyridine-N-oxide (84175-05-3) + 4-nitro-2,2'-bipyridine N-oxide (14163-00-9)

Guidance literature:

With 3-chloro-benzenecarboperoxoic acid; In chloroform; at 0 ℃; for 69h;

DOI:10.1021/jo00151a001

Reference yield:

[2,2]bipyridinyl (366-18-7) → 4'-nitro-2,2'-bipyridine-N-oxide (84175-05-3)

Guidance literature:

Multi-step reaction with 2 steps

1: dihydrogen peroxide; trifluoroacetic acid / 6 h / 20 °C / Inert atmosphere

2: sulfuric acid; nitric acid / 5.25 h / 110 °C / Inert atmosphere

With sulfuric acid; dihydrogen peroxide; nitric acid; trifluoroacetic acid;

DOI:10.1039/c9nj01632e

upstream raw materials:

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

[2,2]bipyridinyl

2,2'-bipyridyl N-oxide

Downstream raw materials:

4,4'-Dinitro-2,2'-bipyridyl N-Oxide

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

4,4'-dichloro-2,2'-bipyridine

4,6'-dichloro-2,2'-bipyridine