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CAS 149771-08-4

:

diethyl 2-(methylsulfanyl)pyrimidine-4,5-dicarboxylate

Description:
Diethyl 2-(methylsulfanyl)pyrimidine-4,5-dicarboxylate is a chemical compound characterized by its pyrimidine core, which is a six-membered aromatic ring containing nitrogen atoms. The presence of two carboxylate groups contributes to its acidic properties, while the diethyl ester functionality enhances its solubility in organic solvents. The methylsulfanyl group introduces a sulfur atom into the structure, which can influence the compound's reactivity and potential biological activity. This compound is typically used in organic synthesis and may serve as an intermediate in the preparation of various pharmaceuticals or agrochemicals. Its molecular structure suggests potential applications in medicinal chemistry, particularly due to the pyrimidine moiety, which is a common scaffold in drug design. Additionally, the presence of ester groups may allow for further derivatization, making it a versatile building block in synthetic chemistry. Safety and handling precautions should be observed, as with all chemical substances, due to potential toxicity or reactivity.
Formula:C11H14N2O4S
InChI:InChI=1/C11H14N2O4S/c1-4-16-9(14)7-6-12-11(18-3)13-8(7)10(15)17-5-2/h6H,4-5H2,1-3H3
SMILES:CCOC(=O)c1cnc(nc1C(=O)OCC)SC
Synonyms:
  • 4,5-Pyrimidinedicarboxylic acid, 2-(methylthio)-, diethyl ester
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