Methyl 3-bromo-5-nitrobenzoate

Base Information

• Chemical Name: Methyl 3-bromo-5-nitrobenzoate
• CAS No.: 6307-87-5
• Molecular Formula: C8H6BrNO4
• Molecular Weight: 260.044
• Hs Code.: 2916399090
• Mol file: 6307-87-5.mol

Synonyms:3-Bromo-5-nitrobenzoicacid methyl ester;Methyl 3-bromo-5-nitrobenzoate;Methyl5-bromo-3-nitrobenzoate;NSC 44296;

Chemical Property of Methyl 3-bromo-5-nitrobenzoate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 70 °C(Solv: ethanol (64-17-5))
• Refractive Index: 1.588
• Boiling Point: 326.042 °C at 760 mmHg
• Flash Point: 150.985 °C
• PSA: 72.12000
• Density: 1.674 g/cm³
• LogP: 2.66710
• Storage Temp.: Sealed in dry,Room Temperature

Purity/Quality:

98%,99%, ^*data from raw suppliers

Methyl3-bromo-5-nitrobenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Methyl 3-bromo-5-nitrobenzoate

There total 9 articles about Methyl 3-bromo-5-nitrobenzoate 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%

methanol (67-56-1) + 3-bromo-5-nitro-benzoic acid (6307-83-1) → methyl 3-bromo-5-nitrobenzoate (6307-87-5)

Guidance literature:

With sulfuric acid; Reflux;

Reference yield: 90.0%

methyl 3-nitrobenzoate (618-95-1) → methyl 3-bromo-5-nitrobenzoate (6307-87-5)

Guidance literature:

With sulfuric acid; dibromoisocyanuric acid;

DOI:10.1002/chem.200501564

Reference yield: 87.0%

3-bromo-5-nitro-benzoic acid (6307-83-1) + methyl iodide (74-88-4) → methyl 3-bromo-5-nitrobenzoate (6307-87-5)

Guidance literature:

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

DOI:10.1021/acs.jmedchem.5b01501

upstream raw materials:

methyl 3-nitrobenzoate

methanol

3-bromo-5-nitro-benzoic acid

methyl iodide

Downstream raw materials:

C₁₄H₈Br₂N₂O₄

methyl 3-(1,1-dioxido-4-phenyltetrahydro-2H-1,2-thiazin-2-yl)-5-nitrobenzoate

methyl 3-nonylamino-5-(pyridine-4'-yl)benzoate

3-nonylamino-5-(pyridine-4'-yl)benzoic acid

Refernces

• 1、 Bonnar, James,Dixon, Ian,Evison, Benny J.,Kelly, Graham E.,Kumar, Sanjay,Lambert, Gilles,Nativel, Brice,Palmer, James T.,Parmar, Jasneet,Rathi, Anuj Kumar,Suchowerska, Alexandra K.,Tang, Wei,Teng, Yanfen,Treutlein, Herbert,Wang, Jie,Xu, Yanfeng,Zeng, Jun,Zhu, Qing,Chemello, Kévin. "A small molecule inhibitor of PCSK9 that antagonizes LDL receptor binding via interaction with a cryptic PCSK9 binding groove". supporting information. . Retrieved 2020/02/13.
• 2、 Xiao, Ming-Yang,Chen, Zhen,Zhang, Fa-Guang,Ma, Jun-An. "Regioselective synthesis of carboxylic and fluoromethyl tetrazoles enabled by silver-catalyzed cycloaddition of diazoacetates and aryl diazonium salts". supporting information. . Retrieved 2020/03/04.