3-{2-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-6-acetylaminobenzoic acid

Base Information

• Chemical Name: 3-{2-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-6-acetylaminobenzoic acid
• CAS No.: 632623-64-4
• Molecular Formula: C₂₇H₂₂BrFN₂O₄
• Molecular Weight: 537.385
• Mol file: 632623-64-4.mol

Synonyms:3-{2-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-6-acetylaminobenzoic acid

Chemical Property of 3-{2-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-6-acetylaminobenzoic acid

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 3-{2-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-6-acetylaminobenzoic acid

There total 3 articles about 3-{2-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-6-acetylaminobenzoic acid 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%

3-{2-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-6-acetylaminobenzoic acid methyl ester → 3-{2-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-6-acetylaminobenzoic acid (632623-64-4)

Guidance literature:

With sodium hydroxide; water; In methanol; at 100 ℃; for 0.0166667h; Microwave irradiation;

Reference yield:

2-acetylamino-5-nitrobenzoic acid methyl ester (5409-45-0) → 3-{2-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-6-acetylaminobenzoic acid (632623-64-4)

Guidance literature:

Multi-step reaction with 3 steps

1: hydrogen / 5%-palladium/activated carbon / methanol / 3 h / 20 °C / 760.05 Torr

2: toluene-4-sulfonic acid / 1-methyl-pyrrolidin-2-one / 0.17 h / 180 °C / Microwave irradiation

3: sodium hydroxide; water / methanol / 0.02 h / 100 °C / Microwave irradiation

With sodium hydroxide; water; hydrogen; 5%-palladium/activated carbon; toluene-4-sulfonic acid; In 1-methyl-pyrrolidin-2-one; methanol;

Reference yield:

1-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-pentane-1,4-dione (632627-07-7) + 6-acetylamino-3-amino-benzoic acid methyl ester (80162-85-2) → 3-{2-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-5-methyl-pyrrol-1-yl}-6-acetylaminobenzoic acid (632623-64-4)

Guidance literature:

Multi-step reaction with 2 steps

1: toluene-4-sulfonic acid / 1-methyl-pyrrolidin-2-one / 0.17 h / 180 °C / Microwave irradiation

2: sodium hydroxide; water / methanol / 0.02 h / 100 °C / Microwave irradiation

With sodium hydroxide; water; toluene-4-sulfonic acid; In 1-methyl-pyrrolidin-2-one; methanol;

upstream raw materials:

1-[5-bromo-2-(4-fluorobenzyloxy)phenyl]-pentane-1,4-dione

6-acetylamino-3-amino-benzoic acid methyl ester

2-acetylamino-5-nitrobenzoic acid methyl ester