2,6-Dinitro-N-(2-nitrophenyl)aniline

Base Information

• Chemical Name: 2,6-Dinitro-N-(2-nitrophenyl)aniline
• CAS No.: 56698-04-5
• Molecular Formula: C12H8 N4 O6
• Molecular Weight: 304.219
• European Community (EC) Number: 260-343-9
• DSSTox Substance ID: DTXSID60205251
• Nikkaji Number: J267.089E
• Wikidata: Q83078760
• Mol file: 56698-04-5.mol

Synonyms:2,6-Dinitro-N-(2-nitrophenyl)aniline;56698-04-5;EINECS 260-343-9;DTXSID60205251;2,6-Dinitro-N-(2-nitrophenyl)benzenamine

Chemical Property of 2,6-Dinitro-N-(2-nitrophenyl)aniline

Chemical Property:

• Vapor Pressure: 8.26E-08mmHg at 25°C
• Boiling Point: 436.2°Cat760mmHg
• Flash Point: 217.6°C
• PSA: 149.49000
• Density: 1.592g/cm³
• LogP: 4.79740
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 304.04438399
• Heavy Atom Count: 22
• Complexity: 420

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)NC2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Technology Process of 2,6-Dinitro-N-(2-nitrophenyl)aniline

There total 1 articles about 2,6-Dinitro-N-(2-nitrophenyl)aniline 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:

o-nitroiodobenzene (609-73-4) + 2,6-dinitroaniline (606-22-4) → (2,6-dinitro-phenyl)-(2-nitro-phenyl)-amine (56698-04-5)

Guidance literature:

With copper; potassium carbonate; nitrobenzene;

DOI:10.1002/hlca.19500330340

Reference yield:

(2,6-dinitro-phenyl)-(2-nitro-phenyl)-amine (56698-04-5) → phenazin-1-ol (528-71-2)

Guidance literature:

Multi-step reaction with 2 steps

1: palladium/charcoal; ethanol / Hydrogenation_.und Oxidation des Reaktionsprodukts mit FeCl₃ in H₂O

2: aqueous H₃PO₄ / 150 - 160 °C

With palladium on activated charcoal; ethanol; phosphoric acid;

DOI:10.1002/hlca.19500330340

Reference yield:

(2,6-dinitro-phenyl)-(2-nitro-phenyl)-amine (56698-04-5) → phenazin-1-ylamine (2876-22-4)

Guidance literature:

With palladium on activated charcoal; ethanol; Hydrogenation_.und Oxidation des Reaktionsprodukts mit FeCl₃ in H₂O;

DOI:10.1002/hlca.19500330340

upstream raw materials:

o-nitroiodobenzene

2,6-dinitroaniline

Downstream raw materials:

phenazin-1-ylamine

phenazin-1-ol