53939-83-6

Basic information

• Product Name: 6-ETHYL-4-HYDROXY-2-MERCAPTOPYRIMIDINE
• Synonyms: BUTTPARK 44\01-43;4-ETHYL-6-HYDROXY-2-MERCAPTOPYRIMIDINE;6-ETHYL-4-HYDROXY-2-MERCAPTOPYRIMIDINE;6-ETHYL-2-THIOXO-2,3-DIHYDRO-4(1H)-PYRIMIDINONE;6-ethyl-2-sulfanylidene-1H-pyrimidin-4-one
• CAS NO: 53939-83-6
• Molecular Formula: C₆H₈N₂OS
• Molecular Weight: 156.21
• Mol File: 53939-83-6.mol
• Article Data: 9

Chemical Properties

• Melting Point: 228-230°C
• Boiling Point: 244.2°C at 760 mmHg
• Flash Point: 101.5°C
• Appearance: /
• Density: 1.29g/cm³
• Vapor Pressure: 0.0308mmHg at 25°C
• Refractive Index: 1.613
• PKA: 7.66±0.20(Predicted)
• CAS DataBase Reference: 6-ETHYL-4-HYDROXY-2-MERCAPTOPYRIMIDINE(CAS DataBase Reference)
• NIST Chemistry Reference: 6-ETHYL-4-HYDROXY-2-MERCAPTOPYRIMIDINE(53939-83-6)
• EPA Substance Registry System: 6-ETHYL-4-HYDROXY-2-MERCAPTOPYRIMIDINE(53939-83-6)

Safety Data

• HazardClass: IRRITANT
• Hazardous Substances Data: 53939-83-6(Hazardous Substances Data)

Usage

Description

6-Ethyl-4-hydroxy-2-mercaptopyrimidine, a pyrimidine derivative with the molecular formula C7H10N2OS, is a chemical compound that features an ethyl group, hydroxyl group, and mercapto group. This versatile compound is recognized for its potential in various industrial applications, particularly in the synthesis of pharmaceuticals and agrochemicals, as well as in the development of new chemical entities and materials.

Uses

Used in Pharmaceutical Industry:
6-Ethyl-4-hydroxy-2-mercaptopyrimidine is utilized as an intermediate in the synthesis of pharmaceutical compounds, contributing to the development of new drugs and therapeutic agents. Its unique structure and functional groups make it a valuable building block in medicinal chemistry.
Used in Agrochemical Industry:
In the agrochemical sector, 6-Ethyl-4-hydroxy-2-mercaptopyrimidine serves as an intermediate for the synthesis of agrochemicals, aiding in the creation of new pesticides, herbicides, and other agricultural products to enhance crop protection and yield.
Used in Chemical Research and Development:
6-Ethyl-4-hydroxy-2-mercaptopyrimidine is employed as a key component in the research and development of new chemical entities, exploring its potential applications in various fields and industries. Its unique properties allow for the creation of novel materials and technologies.
Used in Material Science:
6-ETHYL-4-HYDROXY-2-MERCAPTOPYRIMIDINE is also used as a building block in material science, where it contributes to the synthesis of new materials with specific properties, such as improved stability, reactivity, or selectivity, for use in various applications.
Overall, 6-Ethyl-4-hydroxy-2-mercaptopyrimidine's diverse applications across different industries highlight its importance and potential as a versatile chemical compound with significant implications for future developments in medicine, agriculture, and material science.

InChI:InChI=1/C6H8N2OS/c1-2-4-3-5(9)8-6(10)7-4/h3H,2H2,1H3,(H2,7,8,9,10)

Upstream product

• 17356-08-0 thiourea 
• 4949-44-4 ethyl propanoylacetate 
• 7424-54-6 3,5-heptanedione 
• 609-14-3 2-acetylpropanoic acid ethyl ester 

Downstream Products

• 70967-37-2 6-ethyl-2-(methylthio)pyrimidin-4(3H)-one 
• 15043-03-5 6-ethylpyrimidine-2,4(1H,3H)-dione 
• 900738-63-8 2-(benzylthio)-6-ethylpyrimidin-4(3H)-one 
• 1391978-22-5 N-{5-[4-(4-cyclopropylpiperazin-1-yl)-6-ethylpyrimidin-5-ylethynyl]-2-methylpyridin-3-yl}-4-fluorobenzenesulfonamide 
• 1391978-21-4 N-[5-(4-dimethylamino-6-ethylpyrimidin-5-ylethynyl)-2-methylpyridin-3-yl]-4-fluorobenzenesulfonamide 
• 1391978-20-3 N-[5-(4-ethyl-6-morpholin-4-ylpyrimidin-5-ylethynyl)-2-methoxypyridin-3-yl]-benzenesulfonamide 
• 1391978-19-0 N-[5-(4-ethyl-6-morpholin-4-ylpyrimidin-5-ylethynyl)-2-methoxypyridin-3-yl]-2,4-difluorobenzenesulfonamide 
• 1392099-62-5 N-{5-[4-ethyl-6-(3-fluoro-4-methoxy-phenyl)-pyrimidin-5-ylethynyl]-2-methyl-pyridin-3-yl}-methanesulfonamide 
• 1392099-61-4 N-{5-[4-ethyl-6-(2-methoxy-3-trifluoromethyl-phenyl)-pyrimidin-5-ylethynyl]-2-methyl-pyridin-3-yl}-methanesulfonamide 
• 1392099-56-7 N-{5-[4-(3-dimethylaminomethyl-phenyl)-6-ethyl-pyrimidin-5-ylethynyl]-2-methyl-pyridin-3-yl}-methanesulfonamide 
• 1392099-55-6 N-{5-[4-(3,4-dimethoxy-phenyl)-6-ethyl-pyrimidin-5-ylethynyl]-2-methyl-pyridin-3-yl}-methanesulfonamide 
• 1391979-30-8 N-[5-(4-chloro-6-ethyl-pyrimidin-5-ylethynyl)-2-methyl-pyridin-3-yl]-4-fluoro-benzenesulfonamide 
• 1391979-24-0 N-[5-(4-chloro-6-ethyl-pyrimidin-5-ylethynyl)-2-methyl-pyridin-3-yl]-2,4-difluoro-benzenesulfonamide 

Relevant articles and documents

Regioselective convergent synthesis of 2-arylidene thiazolo[3,2-: A] pyrimidines as potential anti-chikungunya agents

Convergent and convenient regioselective synthesis of novel thiazolo[2,3-a]pyrimidine derivatives was accomplished using the one-pot reaction of 6-ethylthiouracil, bromoacetic acid, anhydrous sodium acetate, acetic anhydride, acetic acid and suitable aldehyde. X-ray crystallographic study reveals the presence of the Z configuration of only one regioisomer confirmed by computational studies as being the most likely isomer present.

PYRAZOLYL PYRIMIDINONE COMPOUNDS AND THE USES THEREOF

The present invention relates to a method of treatment for chronic pain, opioid dependence, alcohol use disorder or autism using a class of pyrimidinone compounds, an adenylyl cyclase 1 (AC1) inhibitor. The invention described herein also pertains to phar

Laccase-catalyzed green synthesis and cytotoxic activity of novel pyrimidobenzothiazoles and catechol thioethers

The laccase-catalyzed reaction between unsubstituted catechol and 2-thioxopyrimidin-4(1H)-ones using aerial O2 as the oxidant delivers novel pyrimidobenzothiazoles with high yields in an aqueous solvent system under mild reaction conditions. With 4-substituted catechols, catechol thioethers are formed exclusively. The synthetic protocols developed provide a sustainable approach for these compound classes. In addition, the cytotoxicity of the products against HepG2 cell line is reported. Most compounds exhibit antiproliferative activities with IC50 values at the micromolar level. A structure-activity relationship study will facilitate the further development of these compounds as cytotoxic agents.