3-(2-Bromo-acetyl)-benzoic acid methyl ester

Base Information

• Chemical Name: 3-(2-Bromo-acetyl)-benzoic acid methyl ester
• CAS No.: 27475-19-0
• Molecular Formula: C10H9 Br O3
• Molecular Weight: 257.084
• Hs Code.: 2918300090
• Mol file: 27475-19-0.mol

Synonyms:Benzoicacid, 3-(bromoacetyl)-, methyl ester (9CI); Benzoic acid, m-(bromoacetyl)-,methyl ester (8CI); 3-(2-Bromoacetyl)benzoic acid methyl ester;3-(2'-Bromoacetyl)benzoic acid methyl ester

Chemical Property of 3-(2-Bromo-acetyl)-benzoic acid methyl ester

Chemical Property:

• Boiling Point: 338.7±22.0 °C(Predicted)
• PSA: 43.37000
• Density: 1.494±0.06 g/cm3(Predicted)
• LogP: 2.05080
• Storage Temp.: Sealed in dry,Room Temperature

Purity/Quality:

98% ^*data from raw suppliers

Methyl3-(2-bromoacetyl)benzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-(2-Bromo-acetyl)-benzoic acid methyl ester

There total 3 articles about 3-(2-Bromo-acetyl)-benzoic acid methyl 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: 100.0%

methyl 3-acetylbenzoate (21860-07-1) → α-bromo-3-acetylbenzoic acid methyl ester (27475-19-0)

Guidance literature:

With hydrogen bromide; bromine; acetic acid; In chloroform; at 0 - 20 ℃; for 2h;

DOI:10.1002/cmdc.201300414

Reference yield: 66.0%

3-(2-bromo-acetyl)-benzoic acid (62423-73-8) + diazomethyl-trimethyl-silane (18107-18-1) → α-bromo-3-acetylbenzoic acid methyl ester (27475-19-0)

Guidance literature:

In methanol; toluene; at 20 ℃; for 0.0833333h;

Reference yield:

3-acetylbenzoic acid (586-42-5) → α-bromo-3-acetylbenzoic acid methyl ester (27475-19-0)

Guidance literature:

Multi-step reaction with 2 steps

2: Br₂

With bromine;

DOI:10.1021/jm00298a022

upstream raw materials:

methyl 3-acetylbenzoate

3-(2-bromo-acetyl)-benzoic acid

diazomethyl-trimethyl-silane

3-acetylbenzoic acid

Downstream raw materials:

3-[2-(Benzyl-tert-butyl-amino)-acetyl]-benzoic acid methyl ester

C₁₄H₉FN₂O₂

Refernces

• 1、 -. "CYANOPYRROLIDINES AS DUB INHIBITORS FOR THE TREATMENT OF CANCER". Page/Page column 108. . Retrieved 2017/02/09.
• 2、 Suzuki, Takayoshi,Muto, Nobusuke,Bando, Masashige,Itoh, Yukihiro,Masaki, Ayako,Ri, Masaki,Ota, Yosuke,Nakagawa, Hidehiko,Iida, Shinsuke,Shirahige, Katsuhiko,Miyata, Naoki. "Design, synthesis, and biological activity of NCC149 derivatives as histone deacetylasea 8-selective inhibitors". . p. 657 - 664. Retrieved 2014/03/21.