2,2',6,6'-Tetranitro-4,4'-azoxytoluene

Base Information

• Chemical Name: 2,2',6,6'-Tetranitro-4,4'-azoxytoluene
• CAS No.: 51857-25-1
• Molecular Formula: C₁₄H₁₀N₆O₉
• Molecular Weight: 406.268
• DSSTox Substance ID: DTXSID001031484
• Mol file: 51857-25-1.mol

Synonyms:2,2',6,6'-tetranitro-4,4'-azoxytoluene;2,2',6,6'-TNAT-4,4'

Chemical Property of 2,2',6,6'-Tetranitro-4,4'-azoxytoluene

Chemical Property:

• Vapor Pressure: 4.5E-13mmHg at 25°C
• Boiling Point: 585.3°C at 760 mmHg
• Flash Point: 307.8°C
• PSA: 224.39000
• Density: 1.74g/cm³
• LogP: 6.47790
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 2
• Exact Mass: 406.05092592
• Heavy Atom Count: 29
• Complexity: 660

Purity/Quality:

99% ^*data from raw suppliers

2,2',6,6'-TETRANITRO-4,4'-AZOXYTOLUENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1[N+](=O)[O-])N=[N+](C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-])[O-])[N+](=O)[O-]

Technology Process of 2,2',6,6'-Tetranitro-4,4'-azoxytoluene

There total 8 articles about 2,2',6,6'-Tetranitro-4,4'-azoxytoluene 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: 89.0%

2,6-dinitro-4-hydroxylaminotoluene (59283-75-9) → 2,2',6,6'-tetranitro-4,4'-azoxytoluene (51857-25-1)

Guidance literature:

Kinetics;

DOI:10.1021/es030010a

Reference yield:

2,4,6-Trinitrotoluene (118-96-7) → 2,2',6,6'-tetranitro-4,4'-azoxytoluene (51857-25-1)

Guidance literature:

Multi-step reaction with 2 steps

1: aqueous alcoholic acetic acid; sodium acetate / 40 - 50 °C / an einer Silberkathode

2: concentrated hydrochloric acid

With hydrogenchloride; sodium acetate; acetic acid;

Reference yield:

2,6-dinitro-4-hydroxylaminotoluene (59283-75-9) → 2,2',6,6'-tetranitro-4,4'-azoxytoluene (51857-25-1) + 4-Amino-2,6-dinitrotoluene (19406-51-0,153919-64-3)

Guidance literature:

With hydrogenchloride;

upstream raw materials:

2,4,6-Trinitrotoluene

4-Amino-2,6-dinitrotoluene

2,6-dinitro-4-hydroxylaminotoluene

1,4-dioxane