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CAS 27058-54-4

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2-methyl-6-oxo-1,6-dihydropyrimidine-5-carbonitrile

Description:
2-Methyl-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, with the CAS number 27058-54-4, is a heterocyclic organic compound characterized by its pyrimidine ring structure, which includes a carbonitrile group and a ketone functionality. This compound typically exhibits a pale yellow to light brown appearance and is soluble in polar organic solvents. Its molecular structure features a methyl group at the 2-position and a carbonitrile group at the 5-position, contributing to its reactivity and potential applications in medicinal chemistry. The presence of the carbonitrile group suggests that it may participate in nucleophilic reactions, while the ketone may engage in condensation reactions. This compound is of interest in the synthesis of various pharmaceuticals and agrochemicals due to its potential biological activity. Additionally, its stability and reactivity can be influenced by the presence of substituents on the pyrimidine ring, making it a versatile building block in organic synthesis.
Formula:C6H5N3O
InChI:InChI=1/C6H5N3O/c1-4-8-3-5(2-7)6(10)9-4/h3H,1H3,(H,8,9,10)
SMILES:Cc1[nH]cc(C#N)c(=O)n1
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