2-NITRO-3-(TRIFLUOROMETHYL)PHENOL

Base Information

• Chemical Name: 2-NITRO-3-(TRIFLUOROMETHYL)PHENOL
• CAS No.: 386-72-1
• Molecular Formula: C7H4F3NO3
• Molecular Weight: 207.109
• Hs Code.: 2908999090
• Mol file: 386-72-1.mol

Synonyms:2-NITRO-3-(TRIFLUOROMETHYL)PHENOL;alpha,alpha,alpha-trifluoro-2-nitro-m-cresol;2-Nitro-3-(trifluoromethyl)phenol, 2-Hydroxy-6-(trifluoromethyl)nitrobenzene;3-Hydroxy-2-nitrobenzotrifluoride

Chemical Property of 2-NITRO-3-(TRIFLUOROMETHYL)PHENOL

Chemical Property:

• Boiling Point: 236.4±40.0 °C(Predicted)
• PKA: 5.66±0.10(Predicted)
• PSA: 66.05000
• Density: 1.554±0.06 g/cm3(Predicted)
• LogP: 2.84240
• Storage Temp.: 2-8°C

Purity/Quality:

98% ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 2-Nitro-3-(trifluoromethyl)phenol, has been shown to have fungicidal activity . It is also an intermediate in the synthesis of the aniline derivatives such as 2-Amino-3-trifluoromethylphenol (A630795).

Technology Process of 2-NITRO-3-(TRIFLUOROMETHYL)PHENOL

There total 3 articles about 2-NITRO-3-(TRIFLUOROMETHYL)PHENOL 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: 88.0%

2-nitrobenzotrifluoride (384-22-5) → 2-nitro-3-(trifluoromethyl)phenol (386-72-1) + 3-trifluoromethyl-4-nitrophenol (88-30-2)

Guidance literature:

With tert.-butylhydroperoxide; potassium tert-butylate; In ammonia; at -33 ℃;

DOI:10.1021/jo970726m

Reference yield: 37.0%

3-Trifluoromethylphenol (98-17-9) → 2-nitro-3-(trifluoromethyl)phenol (386-72-1)

Guidance literature:

With sodium nitrate; sulfuric acid; sodium nitrite; In dichloromethane; water; at 20 ℃;

Reference yield:

2-nitro-3-(trifluoromethyl)aniline (386-71-0) → 2-nitro-3-(trifluoromethyl)phenol (386-72-1)

Guidance literature:

With sodium hydroxide;

DOI:10.1039/jr9500002792

upstream raw materials:

2-nitro-3-(trifluoromethyl)aniline

2-nitrobenzotrifluoride

3-Trifluoromethylphenol

Downstream raw materials:

2-amino-3-(trifluoromethyl)phenol

2-bromo-1-methoxy-3-(trifluoromethyl)benzene

C₂₃H₂₂F₇NO₂