4-Bromo-2-fluoro-6-methylaniline

Base Information

• Chemical Name: 4-Bromo-2-fluoro-6-methylaniline
• CAS No.: 429683-46-5
• Molecular Formula: C7H7BrFN
• European Community (EC) Number: 849-487-9
• Mol file: 429683-46-5.mol

Synonyms:4-bromo-2-fluoro-6-methylaniline;429683-46-5;Benzenamine, 4-bromo-2-fluoro-6-methyl-;MFCD22683228;4-bromo-2-fluoro-6-methylbenzenamine;4-bromo-2-fluoro-6-methyl-aniline;SCHEMBL5346206;SLNCSLAIDQBUKN-UHFFFAOYSA-N;BBL101830;STL555627;AKOS008901210;SB37171;MS-20294;SY322752;DB-205760;CS-0012910;D72496;EN300-159810

Chemical Property of 4-Bromo-2-fluoro-6-methylaniline

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 202.97459
• Heavy Atom Count: 10
• Complexity: 120

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1N)F)Br

Technology Process of 4-Bromo-2-fluoro-6-methylaniline

There total 1 articles about 4-Bromo-2-fluoro-6-methylaniline 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: 98.0%

→ 4-bromo-2-fluoro-6-methylbenzeneamine (429683-46-5)

Guidance literature:

With N-Bromosuccinimide; In acetonitrile; at 10 - 20 ℃; for 1h; Inert atmosphere;

Reference yield: 83.0%

4-bromo-2-fluoro-6-methylbenzeneamine (429683-46-5) + copper(l) cyanide → 4-amino-3-fluoro-5-methylbenzonitrile (1465326-80-0)

Guidance literature:

In 1-methyl-pyrrolidin-2-one; at 200 ℃; for 16h;

Reference yield: 80.0%

zinc(II) cyanide (557-21-1) + 4-bromo-2-fluoro-6-methylbenzeneamine (429683-46-5) → 4-amino-3-fluoro-5-methylbenzonitrile (1465326-80-0)

Guidance literature:

With 1,1'-bis-(diphenylphosphino)ferrocene; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; zinc; In N,N-dimethyl acetamide; at 130 ℃;

Downstream raw materials:

4-amino-3-fluoro-5-methylbenzonitrile

4-[6-(4-cyanophenylamino)-5-fluoropyridin-2-yl]amino-3-fluoro-5-methylbenzonitrile

(E)-3-(4-amino-3-fluoro-5-methylphenyl)acrylonitrile

3-(4-amino-3-fluoro-5-methylphenyl)acrylonitrile

Refernces

• 1、 -. "AMIDO COMPOUNDS AS AhR MODULATORS". Paragraph 0237; 0243. . Retrieved 2019/02/06.