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4-pyrimidinecarboxylic acid, 2-(methylthio)-, ethyl ester

ethyl 2-(methylsulfanyl)pyrimidine-4-carboxylate

CAS: 250726-39-7

Molecular Formula: C8H10N2O2S

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4-pyrimidinecarboxylic acid, 2-(methylthio)-, ethyl ester - Names and Identifiers

Name ethyl 2-(methylsulfanyl)pyrimidine-4-carboxylate
Synonyms LogP
ETHYL 2-(METHYLTHIO)PYRIMIDINE-4-CARBOXYLATE
METHYL2-METHYLSULFANYLPYRIMIDINE-4-CARBOXYLATE
Ethyl 2-(methylsulfanyl)-4-pyrimidinecarboxylate
ethyl 2-(methylsulfanyl)pyrimidine-4-carboxylate
2-(Methylthio)-4-pyrimidinecarboxylic acid ethyl ester
4-pyrimidinecarboxylic acid, 2-(methylthio)-, ethyl ester
4-PyriMidinecarboxylic acid, 2-(Methylthio)-, ethyl ester
CAS 250726-39-7
InChI InChI=1/C8H10N2O2S/c1-3-12-7(11)6-4-5-9-8(10-6)13-2/h4-5H,3H2,1-2H3

4-pyrimidinecarboxylic acid, 2-(methylthio)-, ethyl ester - Physico-chemical Properties

Molecular FormulaC8H10N2O2S
Molar Mass198.24
Density1.24
Boling Point313.5±15.0 °C(Predicted)
Flash Point143.4°C
Vapor Presure0.000495mmHg at 25°C
pKa-1.43±0.20(Predicted)
Storage ConditionKeep in dark place,Sealed in dry,Room Temperature
Refractive Index1.552

4-pyrimidinecarboxylic acid, 2-(methylthio)-, ethyl ester - Introduction

ethyl 2-(methylsulfanyl)pyrimidine-4-carboxylate is an organic compound with the chemical formula C8H10N2O2S. The following is a description of the properties, uses, preparation and safety information of this compound:

Nature:
-Appearance: ethyl 2-(methylsulfanyl)pyrimidine-4-carboxylate is a colorless to pale yellow solid.
-Solubility: It is soluble in common organic solvents, such as ethanol, dimethylformamide and ethyl acetate.
-Melting point: Its melting point range is about 43-46 degrees Celsius.
-Spectral properties: It has characteristic absorption peaks in the ultraviolet and infrared spectra.
-Reactivity: ethyl 2-(methylsulfanyl)pyrimidine-4-carboxylate can undergo various chemical reactions with other compounds, such as transesterification and electrophilic reactions.

Use:
-Chemical synthesis raw material: ethyl 2-(methylsulfanyl)pyrimidine-4-carboxylate can be used as an intermediate in organic synthesis and used to synthesize other compounds, such as drugs and pesticides.
-Pesticides: Its derivatives are used as pesticides and herbicides in agriculture.

Method:
ethyl 2-(methylsulfanyl)pyrimidine-4-carboxylate can be synthesized by the following steps:
1. Methylthiopyrimidine and ethyl chloroacetate react to generate 2-(methylthio) pyrimidine -4-ethyl acetate.
2. The reaction of ethyl 2-(methylthio) pyrimidine-4-acetate with diethyl carbonate produces the final product ethyl 2-(methylsulfanyl)pyrimidine-4-carboxylate.

Safety Information:
- ethyl 2-(methylsulfanyl)pyrimidine-4-carboxylate is irritating to the eyes, skin and respiratory tract and should be avoided. Personal protective equipment such as gloves and protective glasses should be worn during use.
-During use, good ventilation should be maintained to avoid inhaling its vapor.
-If you accidentally swallow or come into contact with this compound, seek medical attention immediately and carry the compound's packaging or label.

This information is based on the most common laboratory uses, but please note that depending on the specific use or experimental conditions, there may be other safety precautions. Therefore, when using and handling this compound, be sure to consult the complete safety data sheet and any relevant literature.
Last Update:2024-04-09 20:48:19
4-pyrimidinecarboxylic acid, 2-(methylthio)-, ethyl ester
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