2-nitro-3-(trifluoromethyl)aniline

Base Information

• Chemical Name: 2-nitro-3-(trifluoromethyl)aniline
• CAS No.: 386-71-0
• Molecular Formula: C7H5F3N2O2
• Molecular Weight: 206.124
• Hs Code.: 2921420090
• Mol file: 386-71-0.mol

Synonyms:(2-Nitro-3-trifluoromethylphenyl)amine;2-Nitro-3-(trifluoromethyl)aniline;3-Amino-2-nitrobenzotrifluoride;3-Trifluoromethyl-2-nitroaniline;NSC 10269;

Chemical Property of 2-nitro-3-(trifluoromethyl)aniline

Chemical Property:

• Melting Point: 64 °C
• Boiling Point: 287.2 °C at 760 mmHg
• PKA: -1.45±0.10(Predicted)
• Flash Point: 127.5 °C
• PSA: 71.84000
• Density: 1.503 g/cm³
• LogP: 3.30020
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C

Purity/Quality:

98%min ^*data from raw suppliers

2-Nitro-3-(trifluoromethyl)aniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 2-nitro-3-(trifluoromethyl)aniline

There total 4 articles about 2-nitro-3-(trifluoromethyl)aniline 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: 100.0%

N-(2-nitro-3-(trifluoromethyl)phenyl)acetamide (387-19-9) → 2-nitro-3-(trifluoromethyl)aniline (386-71-0)

Guidance literature:

With water; sodium hydroxide; In methanol; at 60 ℃; for 1h;

DOI:10.1016/j.bmcl.2009.11.099

Reference yield: 33.0%

2-nitrobenzotrifluoride (384-22-5) → 4-nitro-3-(trifluoromethyl)benzeneamine (393-11-3) + 2-nitro-3-(trifluoromethyl)aniline (386-71-0)

Guidance literature:

With 2,4,6-trichlorosulfenamide; potassium tert-butylate; In N,N-dimethyl-formamide; at 20 ℃; for 0.333333h;

DOI:10.1021/jo970582b

Reference yield:

N-acetyl-3-trifluoromethylbenzenamine (351-36-0) → 2-nitro-3-(trifluoromethyl)aniline (386-71-0)

Guidance literature:

Multi-step reaction with 2 steps

2: NaOH-solution / Verseifung

With sodium hydroxide;

upstream raw materials:

N-(2-nitro-3-(trifluoromethyl)phenyl)acetamide

2-nitrobenzotrifluoride

N-acetyl-3-trifluoromethylbenzenamine

Downstream raw materials:

N-(2-chloro-5-methoxyphenyl)-2-nitro-3-(trifluoromethyl)aniline

N-{3-[3-(methylsulfonyl)phenoxy]phenyl}-2-nitro-3-(trifluoromethyl)aniline

N-(3-methoxyphenyl)-2-nitro-3-(trifluoromethyl)aniline

2-Amino-3-trifluormethyl-diphenylamin

Refernces

• 1、 Travins, Jeremy M.,Bernotas, Ronald C.,Kaufman, David H.,Quinet, Elaine,Nambi, Ponnal,Feingold, Irene,Huselton, Christine,Wilhelmsson, Anna,Goos-Nilsson, Annika,Wrobel, Jay. "1-(3-Aryloxyaryl)benzimidazole sulfones are liver X receptor agonists". scheme or table. p. 526 - 530. Retrieved 2010/05/19.
• 2、 -. "Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity". Page/Page column 45; 46. . Retrieved 2010/02/11.