2,4,6-Tribromo-N,N-dimethylaniline

Base Information

• Chemical Name: 2,4,6-Tribromo-N,N-dimethylaniline
• CAS No.: 63812-39-5
• Molecular Formula: C8H8Br3N
• Molecular Weight: 357.86800
• DSSTox Substance ID: DTXSID20510338
• Wikidata: Q82368562
• Mol file: 63812-39-5.mol

Synonyms:2,4,6-Tribromo-N,N-dimethylaniline;63812-39-5;DTXSID20510338

Chemical Property of 2,4,6-Tribromo-N,N-dimethylaniline

Chemical Property:

• Melting Point: 124-125 °C(Solv: ethanol (64-17-5))
• Boiling Point: 332.2±42.0 °C(Predicted)
• PSA: 3.24000
• Density: 2.033±0.06 g/cm3(Predicted)
• LogP: 4.04010
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 356.81864
• Heavy Atom Count: 12
• Complexity: 139

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=C(C=C(C=C1Br)Br)Br

Technology Process of 2,4,6-Tribromo-N,N-dimethylaniline

There total 3 articles about 2,4,6-Tribromo-N,N-dimethylaniline 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: 95.0%

N,N-dimethyl-aniline (121-69-7,77733-26-7) → 2,4,6-tribromo-N,N-dimethylaniline (63812-39-5)

Guidance literature:

With potassium permanganate; hydrogen bromide; In acetonitrile; at 60 ℃;

DOI:10.1002/jccs.199600010

Reference yield:

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 2,4,6-tribromoaniline (147-82-0) → 2,4,6-tribromo-N,N-dimethylaniline (63812-39-5)

Guidance literature:

With formic acid; water;

DOI:10.1039/jr9490002663

Reference yield:

2,4,6-tribromoaniline (147-82-0) + dimethyl sulfate (77-78-1) → 2,4,6-tribromo-N,N-dimethylaniline (63812-39-5)

Guidance literature:

With water; sodium carbonate;

upstream raw materials:

formaldehyd

2,4,6-tribromoaniline

dimethyl sulfate

N,N-dimethyl-aniline

Downstream raw materials:

2,4,6-tribromo-N-methyl-N-nitroso-aniline

2,4,6-tribromo-N-methylaniline

N,N-dimethylaniline-2,4,6-d₃