Benzoic acid,3-amino-5-fluoro-4-methyl-, ethyl ester

Base Information

• Chemical Name: Benzoic acid,3-amino-5-fluoro-4-methyl-, ethyl ester
• CAS No.: 713-47-3
• Molecular Formula: C10H12 F N O2
• Molecular Weight: 197.209
• Mol file: 713-47-3.mol

Synonyms:p-Toluicacid, 3-amino-5-fluoro-, ethyl ester (6CI,8CI)

Chemical Property of Benzoic acid,3-amino-5-fluoro-4-methyl-, ethyl ester

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 322.316°C at 760 mmHg
• PKA: 2.34±0.10(Predicted)
• Flash Point: 148.732°C
• PSA: 52.32000
• Density: 1.184g/cm³
• LogP: 2.47420
• Storage Temp.: 2-8°C

Purity/Quality:

99% ^*data from raw suppliers

Ethyl3-amino-5-fluoro-4-methylbenzoate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Benzoic acid,3-amino-5-fluoro-4-methyl-, ethyl ester

There total 3 articles about Benzoic acid,3-amino-5-fluoro-4-methyl-, ethyl ester 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:

ethyl 3-fluoro-4-methyl-5-nitrobenzoate (2248-38-6) → 3-amino-5-fluoro-4-methyl-benzoic acid, ethyl ester (713-47-3)

Guidance literature:

With hydrogen; nickel;

DOI:10.1039/jr9600000672

Reference yield:

ethyl 3-amino-4-methyl-5-nitrobenzoate (99069-09-7) → 3-amino-5-fluoro-4-methyl-benzoic acid, ethyl ester (713-47-3)

Guidance literature:

Multi-step reaction with 3 steps

1: (diazotization)

2: (pyrolysis)

3: H₂ / Raney-Ni

With hydrogen; nickel;

DOI:10.1039/jr9600000672

Reference yield:

5-Nitro-3-diazonium-p-toluolsaeureethylester → 3-amino-5-fluoro-4-methyl-benzoic acid, ethyl ester (713-47-3)

Guidance literature:

Multi-step reaction with 2 steps

1: (pyrolysis)

2: H₂ / Raney-Ni

With hydrogen; nickel;

DOI:10.1039/jr9600000672

upstream raw materials:

ethyl 3-fluoro-4-methyl-5-nitrobenzoate

ethyl 3-amino-4-methyl-5-nitrobenzoate

Downstream raw materials:

N-cyclopropyl-3-[3-[[1-[2-[2-[[(2S)-2-hydroxypropyl]amino]ethoxy]phenyl]cyclopropyl]amino]-2-oxo-1(2H)-pyrazinyl]-4-methyl-benzamide

3-[5-bromo-3-[[1-methyl-1-[2-(phenylmethoxy)phenyl]ethyl]amino]-2-oxo-1(2H)-pyrazinyl]-N-cyclopropyl-5-fluoro-4-methyl-benzamide

N-cyclopropyl-3-[3-[[1-[2-[2-(ethylamino)ethoxy]phenyl]-1-methylethyl]amino]-2-oxo-1(2H)-pyrazinyl]-5-fluoro-4-methyl-benzamide

3-[5-bromo-3-[[1-methyl-1-[2-(phenylmethoxy)phenyl]ethyl]amino]-2-oxo-1(2H)-pyrazinyl]-5-fluoro-4-methyl-benzoic acid, ethyl ester

Refernces