5-BROMO-2-METHYL-3-NITROPHENYL METHYLCARBOXYLATE

Base Information

• Chemical Name: 5-BROMO-2-METHYL-3-NITROPHENYL METHYLCARBOXYLATE
• CAS No.: 220514-28-3
• Molecular Formula: C9H8BrNO4
• Molecular Weight: 274.071
• Hs Code.: 2916399090
• Mol file: 220514-28-3.mol

Synonyms:Methyl 5-bromo-2-methyl-3-nitro-benzoate;

Chemical Property of 5-BROMO-2-METHYL-3-NITROPHENYL METHYLCARBOXYLATE

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 51.0 to 55.0 °C
• Refractive Index: 1.58
• Boiling Point: 329.563 °C at 760 mmHg
• Flash Point: 153.114 °C
• PSA: 72.12000
• Density: 1.597 g/cm³
• LogP: 2.97550
• Storage Temp.: Sealed in dry,Room Temperature

Purity/Quality:

99% ^*data from raw suppliers

Methyl 5-Bromo-2-methyl-3-nitrobenzoate >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 5-BROMO-2-METHYL-3-NITROPHENYL METHYLCARBOXYLATE

There total 8 articles about 5-BROMO-2-METHYL-3-NITROPHENYL METHYLCARBOXYLATE 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%

5-bromo-2-methyl-3-nitro-benzoic acid (107650-20-4) + methyl iodide (74-88-4) → 5-bromo-2-methyl-3-nitrobenzoic acid methyl ester (220514-28-3)

Guidance literature:

With sodium carbonate; In N,N-dimethyl-formamide; at 60 ℃; for 8h;

Reference yield: 95.0%

methanol (67-56-1) + 5-bromo-2-methyl-3-nitro-benzoic acid (107650-20-4) → 5-bromo-2-methyl-3-nitrobenzoic acid methyl ester (220514-28-3)

Guidance literature:

With thionyl chloride; Reflux;

Reference yield: 34.0%

methyl 2-methyl-5-bromobenzoate (79669-50-4) → 5-bromo-2-methyl-3-nitrobenzoic acid methyl ester (220514-28-3)

Guidance literature:

With sulfuric acid; nitric acid; at 0 - 20 ℃; for 2h;

upstream raw materials:

5-bromo-2-methyl-3-nitro-benzoic acid

methyl iodide

2-methyl-3-nitrobenzic acid

5-bromo-2-methylbenzoic acid

Downstream raw materials:

methyl 5-nitro-3'-(ethylsulfonyl)-4-methylbiphenyl-3-carboxylate

methyl 6-bromo-1H-indazole-4-carboxylate

6-bromo-1-(1-methylethyl)-1H-indazole-4-carboxylic acid

methyl 6-bromo-1-(1-methylethyl)-1H-indazole-4-carboxylate

Refernces

• 1、 Ning, Xiang-Li,Li, Yu-Zhi,Huo, Cui,Deng, Ji,Gao, Cheng,Zhu, Kai-Rong,Wang, Miao,Wu, Yu-Xiang,Yu, Jun-Lin,Ren, Ya-Li,Luo, Zong-Yuan,Li, Gen,Chen, Yang,Wang, Si-Yao,Peng, Cheng,Yang, Ling-Ling,Wang, Zhou-Yu,Wu, Yong,Qian, Shan,Li, Guo-Bo. "X-ray Structure-Guided Discovery of a Potent, Orally Bioavailable, Dual Human Indoleamine/Tryptophan 2,3-Dioxygenase (hIDO/hTDO) Inhibitor That Shows Activity in a Mouse Model of Parkinson’s Disease". . p. 8303 - 8332. Retrieved 2021/06/30.
• 2、 Sawant, Ajay S.,Kamble, Sonali S.,Pisal, Parshuram M.,Meshram, Rohan J.,Sawant, Sanjay S.,Kamble, Vilas A.,Kamble, Vinod T.,Gacche, Rajesh N.. "Synthesis and evaluation of a novel series of 6-bromo-1-cyclopentyl-1H-indazole-4-carboxylic acid-substituted amide derivatives as anticancer, antiangiogenic, and antioxidant agents". . p. 17 - 32. Retrieved 2019/11/14.