2,4,6-Tribromo-3-nitroaniline

Base Information

• Chemical Name: 2,4,6-Tribromo-3-nitroaniline
• CAS No.: 62406-72-8
• Molecular Formula: C6H3Br3N2O2
• Molecular Weight: 374.814
• Hs Code.: 2921420090
• DSSTox Substance ID: DTXSID70478333
• Nikkaji Number: J257.645G
• Wikidata: Q82311659
• Mol file: 62406-72-8.mol

Synonyms:2,4,6-Tribromo-3-nitroaniline;62406-72-8;3-nitro-2,4,6-tribromoaniline;DTXSID70478333;2,4,6-tris(bromanyl)-3-nitro-aniline;A815958

Chemical Property of 2,4,6-Tribromo-3-nitroaniline

Chemical Property:

• Vapor Pressure: 0.000342mmHg at 25°C
• Melting Point: 95-97°C
• Boiling Point: 319.3oC at 760 mmHg
• Flash Point: 146.9oC
• PSA: 71.84000
• Density: 2.464g/cm3
• LogP: 4.56890
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 373.77242
• Heavy Atom Count: 13
• Complexity: 211

Purity/Quality:

98% ^*data from raw suppliers

2,4,6-Tribromo-3-nitroaniline 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2,4,6-Tribromo-3-nitroaniline

There total 17 articles about 2,4,6-Tribromo-3-nitroaniline 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: 97.0%

3-nitro-aniline (99-09-2) → 2,4,6-tribromo-3-nitro-aniline (62406-72-8)

Guidance literature:

With bromine; calcium bromide; In water; at 25 ℃; for 0.25h; regioselective reaction;

DOI:10.1039/c1gc15359e

Reference yield:

3-nitro-aniline (99-09-2) → 2-bromo 5-nitroaniline (10403-47-1) + 2,4,6-tribromo-3-nitro-aniline (62406-72-8)

Guidance literature:

With bromine; acetic acid;

Reference yield:

chloroform (67-66-3,8013-54-5) + bromine (7726-95-6) + 3-nitro-aniline (99-09-2) → 2-bromo 5-nitroaniline (10403-47-1) + 2,4,6-tribromo-3-nitro-aniline (62406-72-8)

Guidance literature:

upstream raw materials:

3-nitroaniline-6-sulphonic acid

4-bromo-3-nitroaniline

2,4,6-tribromoacetanilide

1,3-bis-(3-nitro-phenyl)-triazene

Downstream raw materials:

2,4,6-tribromonitrobenzene

N-(2,4,6-tribromo-3-nitro-phenyl)-diacetamide