Methyl 4-(broMoMethyl)-3-(trifluoroMethyl)benzoate

Base Information

• Chemical Name: Methyl 4-(broMoMethyl)-3-(trifluoroMethyl)benzoate
• CAS No.: 863248-28-6
• Molecular Formula: C10H8BrF3O2
• Molecular Weight: 297.072
• Hs Code.: 2916399090
• Mol file: 863248-28-6.mol

Synonyms:4-bromomethyl-3-trifluoromethyl-benzoic acid methyl ester;Benzoic acid,4-(bromomethyl)-3-(trifluoromethyl)-,methyl ester;

Chemical Property of Methyl 4-(broMoMethyl)-3-(trifluoroMethyl)benzoate

Chemical Property:

• Boiling Point: 289.9±40.0 °C(Predicted)
• PSA: 26.30000
• Density: 1.560±0.06 g/cm3(Predicted)
• LogP: 3.38690

Purity/Quality:

99% ^*data from raw suppliers

Methyl4-(bromomethyl)-3-(trifluoromethyl)benzoate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Methyl 4-(broMoMethyl)-3-(trifluoroMethyl)benzoate

There total 3 articles about Methyl 4-(broMoMethyl)-3-(trifluoroMethyl)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: 96.9%

4-methyl-3-(trifluoromethyl)benzoic acid methyl ester (116419-94-4) → 4-(bromomethyl)-3-(trifluoromethyl)benzoic acid methyl ester (863248-28-6)

Guidance literature:

With N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile); In tetrachloromethane; Reflux;

DOI:10.1016/j.ejphar.2021.173944

Reference yield: 89.0%

→ 4-(bromomethyl)-3-(trifluoromethyl)benzoic acid methyl ester (863248-28-6)

Guidance literature:

Reference yield:

4-methyl-3-(trifluoromethyl)benzoic acid (261952-01-6) → 4-(bromomethyl)-3-(trifluoromethyl)benzoic acid methyl ester (863248-28-6)

Guidance literature:

Multi-step reaction with 2 steps

1: sulfuric acid / 12 h / Reflux

2: N-Bromosuccinimide / dibenzoyl peroxide / tetrachloromethane / 24 h / Reflux

With N-Bromosuccinimide; sulfuric acid; dibenzoyl peroxide; In tetrachloromethane;

upstream raw materials:

4-methyl-3-(trifluoromethyl)benzoic acid methyl ester

4-methyl-3-(trifluoromethyl)benzoic acid

Downstream raw materials:

4-(4-methylpiperazin-1-ylmethyl)-3-trifluoromethylbenzoic acid methyl ester

4-dimethylaminomethyl-3-trifluoromethyl-benzoic acid methyl ester

methyl 4-[(cyclopropylamino)methyl]-3-(trifluoromethyl)benzoate

methyl 4-((methylamino)methyl)-3-(trifluoromethyl)benzoate

Refernces

• 1、 Chin, Frederick T.,Kooijman, Esther J. M.,Nezam, Madina,Reyes, Samantha T.,Shen, Bin,Windhorst, Albert D.,van der Wildt, Berend. "Evaluation of carbon-11 labeled 5-(1-methyl-1H-pyrazol-4-yl)-N-(2-methyl-5-(3-(trifluoromethyl)benzamido)phenyl)nicotinamide as PET tracer for imaging of CSF-1R expression in the brain". . . Retrieved 2021/06/15.
• 2、 -. "A novel structure of the kinase inhibitors". Paragraph 0101; 0109; 0110. . Retrieved 2018/06/07.