Methyl 4-Amino-3-Fluoro-5-Nitro-2-(Phenylamino)Benzoate

Base Information

• Chemical Name: Methyl 4-Amino-3-Fluoro-5-Nitro-2-(Phenylamino)Benzoate
• CAS No.: 606093-58-7
• Molecular Formula: C14H12 F N3 O4
• Molecular Weight: 305.265
• Hs Code.: 2922499990
• Mol file: 606093-58-7.mol

Synonyms:4-Amino-3-fluoro-5-nitro-2-phenylaminobenzoicacid methyl ester; Methyl 4-amino-3-fluoro-5-nitro-2-(phenylamino)benzoate

Chemical Property of Methyl 4-Amino-3-Fluoro-5-Nitro-2-(Phenylamino)Benzoate

Chemical Property:

• Vapor Pressure: 3.39E-09mmHg at 25°C
• Boiling Point: 475.2oC at 760 mmHg
• PKA: -4.00±0.25(Predicted)
• Flash Point: 241.2oC
• PSA: 110.17000
• Density: 1.441g/cm3
• LogP: 4.02370
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature

Purity/Quality:

97% ^*data from raw suppliers

Methyl 4-amino-3-fluoro-5-nitro-2-(phenylamino)benzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Methyl 4-Amino-3-Fluoro-5-Nitro-2-(Phenylamino)Benzoate

There total 5 articles about Methyl 4-Amino-3-Fluoro-5-Nitro-2-(Phenylamino)Benzoate 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: 90.0%

4-Amino-2,3-difluoro-5-nitro-benzoic acid methyl ester (284030-58-6) + aniline (62-53-3) → 4-Amino-3-fluoro-5-nitro-2-phenylamino-benzoic acid methyl ester (606093-58-7)

Guidance literature:

In xylene; at 125 ℃; for 16h;

Reference yield:

2,3,4-trifluoro-5-nitro-benzoic acid (197520-71-1) → 4-Amino-3-fluoro-5-nitro-2-phenylamino-benzoic acid methyl ester (606093-58-7)

Guidance literature:

Multi-step reaction with 3 steps

1: ammonium hydroxide / water / 6 h / 0 °C

2: methanol / 1 h / 0 °C

3: 5,5-dimethyl-1,3-cyclohexadiene / 10 h / 125 °C

With ammonium hydroxide; In methanol; 5,5-dimethyl-1,3-cyclohexadiene; water;

Reference yield:

4-Amino-2,3-difluoro-5-nitro-benzoic acid methyl ester (284030-58-6) → 4-Amino-3-fluoro-5-nitro-2-phenylamino-benzoic acid methyl ester (606093-58-7)

Guidance literature:

With aniline; In dichloromethane;

upstream raw materials:

4-Amino-2,3-difluoro-5-nitro-benzoic acid methyl ester

aniline

2,3,4,-trifluorobenzoic acid

2,3,4-trifluoro-5-nitro-benzoic acid

Downstream raw materials:

4,5-diamino-3-fluoro-2-phenylamino-benzoic acid methyl ester

selumetinib

5-[(4-bromo-2-chlorophenyl)amino]-N-[2-(ethenyloxy)ethoxy]-4-fluoro-1-methyl-1H-benzimidazole-6-carboxamide

5-[(4-bromo-2-chlorophenyl)amino]-4-fluoro-1-methyl-1H-benzimidazole-6-carboxylic acid