Methyl 5-(broMoMethyl)-2-fluorobenzoate

Base Information

• Chemical Name: Methyl 5-(broMoMethyl)-2-fluorobenzoate
• CAS No.: 709-45-5
• Molecular Formula: C9H8BrFO2
• Molecular Weight: 247.064
• Hs Code.: 2916399090
• Mol file: 709-45-5.mol

Synonyms:4-fluoro-3-carbomethoxybenzyl bromide;methyl 3-bromomethyl-6-fluorobenzoate;Benzoic acid,5-(bromomethyl)-2-fluoro-,methyl ester;Methyl 5-bromomethyl-2-fluorobenzoate;

Chemical Property of Methyl 5-(broMoMethyl)-2-fluorobenzoate

Chemical Property:

• Boiling Point: 304.0±37.0 °C(Predicted)
• PSA: 26.30000
• Density: 1.534±0.06 g/cm3(Predicted)
• LogP: 2.50720
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C

Purity/Quality:

99.99%HPLC ^*data from raw suppliers

Methyl 5-(bromomethyl)-2-fluorobenzoate 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Methyl 5-(broMoMethyl)-2-fluorobenzoate

There total 8 articles about Methyl 5-(broMoMethyl)-2-fluorobenzoate 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: 97.0%

2-fluoro-5-methyl benzoic acid methyl ester (2967-93-3) → 2-fluoro-5-bromomethyl benzoic acid methyl ester (709-45-5)

Guidance literature:

With N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile); In chloroform; at 70 ℃; for 12h;

Reference yield: 71.0%

methyl 2-fluoro-5-(hydroxymethyl)benzoate (816449-70-4) → 2-fluoro-5-bromomethyl benzoic acid methyl ester (709-45-5)

Guidance literature:

With phosphorus tribromide; In dichloromethane; at 20 ℃; for 3h;

Reference yield: 66.0%

→ 2-fluoro-5-bromomethyl benzoic acid methyl ester (709-45-5)

Guidance literature:

upstream raw materials:

2-fluoro-5-methyl benzoic acid methyl ester

2-fluoro-5-methyl-benzoic acid

2-fluoro-5-methylbenzonitrile

methyl 2-fluoro-5-(hydroxymethyl)benzoate

Downstream raw materials:

allyl 5-bromomethyl-2-fluorobenzoate

methyl 5-(cyanomethyl)-2-fluorobenzoate

1-[4-fluoro-3-(piperazin-1-ylcarbonyl)benzyl]quinolin-4(1H)-one

tert-butyl 4-{2-fluoro-5-[(4-oxoquinolin-1(4H)-yl)methyl]benzoyl}piperazine-1-carboxylate

Refernces

• 1、 Deng, Xiaoyan,Jiang, Neng,Jiang, Weizhe,Li, Qing,Meng, Liuwei,Xing, Junhao,Xu, Yanjun. "Identification and structure–activity relationship exploration of uracil-based benzoic acid and ester derivatives as novel dipeptidyl Peptidase-4 inhibitors for the treatment of type 2 diabetes mellitus". . . Retrieved 2021/08/17.
• 2、 -. "Quinazoline diketone salt compound containing piperazinone as well as preparation method, pharmaceutical composition and application thereof". Paragraph 0075-0078. . Retrieved 2020/07/02.