1,3,5-Tribromo-2,4-dinitro-benzene

Base Information

• Chemical Name: 1,3,5-Tribromo-2,4-dinitro-benzene
• CAS No.: 51686-79-4
• Molecular Formula: C6HBr3N2O4
• Molecular Weight: 404.797
• DSSTox Substance ID: DTXSID501298827
• Nikkaji Number: J1.191.192G
• Mol file: 51686-79-4.mol

Synonyms:1,3,5-tribromo-2,4-dinitrobenzene;1,3,5-tribromo-2,4-dinitro-benzene;SCHEMBL18510270;DTXSID501298827;1,3,5-Tribrom-2,4-dinitrobenzol;AKOS024427545;51686-79-4

Chemical Property of 1,3,5-Tribromo-2,4-dinitro-benzene

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 403.74659
• Heavy Atom Count: 15
• Complexity: 253

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=C(C(=C(C(=C1Br)[N+](=O)[O-])Br)[N+](=O)[O-])Br

Technology Process of 1,3,5-Tribromo-2,4-dinitro-benzene

There total 5 articles about 1,3,5-Tribromo-2,4-dinitro-benzene 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:

1,3,5-tribromo-2,4,6-trinitrobenzene (83430-12-0) → hexabromobenzene (87-82-1) + pentabromonitrobenzene (22230-46-2) + 1,3-dibromo-2,4,6-trinitrobenzene (13506-78-0) + 1,2,3,5-tetrabromo-4,6-dinitro-benzene (22230-07-5) + 2,4,6-tribromo-1,3-dinitrobenzene (51686-79-4)

Guidance literature:

In benzene; at 340 ℃; Product distribution; Kinetics; Rate constant; in sealed tube; other solvent (neat); other temp.;

DOI:10.1021/j100023a043

Reference yield:

2,4,6-tribromo-3,5-dinitro-benzenesulfonic acid + water (7732-18-5) → sulfuric acid (7664-93-9) + 2,4,6-tribromo-1,3-dinitrobenzene (51686-79-4)

Guidance literature:

at 230 ℃;

Reference yield:

1,2,3-tribromobenzene (608-21-9) → 2,4,6-tribromo-1,3-dinitrobenzene (51686-79-4)

Guidance literature:

With nitric acid;

upstream raw materials:

1,2,3-tribromobenzene

1,3,5-tribromo-2,4,6-trinitrobenzene

2,4,6-tribromoiodobenzene

nitric acid

Downstream raw materials:

1,3,5-trimethoxy-2,4-dinitro-benzene

1,5-diethoxy-2,4-dinitro-benzene

2,4,6-tribromo-3-nitrophenol

5-ethoxy-2,4-dinitro-phenol