Methyl-5-bromo-2 pyrimidine carboxylate

Base Information

• Chemical Name: Methyl-5-bromo-2 pyrimidine carboxylate
• CAS No.: 89581-38-4
• Molecular Formula: C6H5BrN2O2
• Molecular Weight: 217.022
• Hs Code.: 29335990
• Mol file: 89581-38-4.mol

Synonyms:5-Bromopyrimidine-2-carboxylicacid methyl ester;

Chemical Property of Methyl-5-bromo-2 pyrimidine carboxylate

Chemical Property:

• Vapor Pressure: 0.000467mmHg at 25°C
• Melting Point: 149°C(lit.)
• Refractive Index: 1.558
• Boiling Point: 314.4 °C at 760 mmHg
• PKA: -2.81±0.22(Predicted)
• Flash Point: 143.9 °C
• PSA: 52.08000
• Density: 1.669 g/cm³
• LogP: 1.02570
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility.: soluble in Methanol

Purity/Quality:

96% 1H NMR ^*data from raw suppliers

5-Bromopyrimidine-2-carboxylicAcidMethylEster ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 5-Bromopyrimidine-2-carboxylic Acid Methyl Ester is used in the study of metabotropic glutamate receptor 5 (mGlu5) positive allosteric modulators (PAMs)?.

Technology Process of Methyl-5-bromo-2 pyrimidine carboxylate

There total 5 articles about Methyl-5-bromo-2 pyrimidine carboxylate 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: 71.0%

methanol (67-56-1) + 5-bromopyrimidine-2-carbonitrile (38275-57-9) → 5-bromopyrimidine-2-carboxylic acid methyl ester (89581-38-4)

Guidance literature:

With hydrogenchloride; In water; at 80 ℃; for 2h; Inert atmosphere;

Reference yield: 67.0%

methanol (67-56-1) + 5-bromo-2-pyrimidinecarboxylic acid (37131-87-6) → 5-bromopyrimidine-2-carboxylic acid methyl ester (89581-38-4)

Guidance literature:

With acetyl chloride; for 0.25h; Reflux;

Reference yield:

methanol (67-56-1) + 5-bromopyridine-2-carboxylic acid chloride (1013335-78-8) → 5-bromopyrimidine-2-carboxylic acid methyl ester (89581-38-4)

Guidance literature:

In dichloromethane; at 0 ℃; for 2h;

upstream raw materials:

methanol

5-bromo-2-pyrimidinecarboxylic acid

5-bromopyrimidine-2-carbonitrile

5-bromopyridine-2-carboxylic acid chloride

Downstream raw materials:

5-bromo-pyrimidine-2-carboxylic acid amide

methyl 5-(dimethylphosphoryl)pyrimidine-2-carboxylate

Refernces

• 1、 -. "CYCLOPROPYL FUSED THIAZIN-2-AMINE COMPOUNDS AS BETA-SECRETASE INHIBITORS AND METHODS OF USE". Page/Page column 328. . Retrieved 2016/04/20.
• 2、 -. "P2X7 MODULATORS". Paragraph 0126; 0169; 0170. . Retrieved 2014/09/30.