2(1H)-Pyridinone, 1-methyl-3,5-dinitro-


Chemical Name: 2(1H)-Pyridinone, 1-methyl-3,5-dinitro-
CAS Number: 14150-94-8
Product Number: AG001GI8(AGN-PC-0KXI3F)
Synonyms:
MDL No:
Molecular Formula: C6H5N3O5
Molecular Weight: 199.1210

Identification/Properties


Properties
MP:
174-178℃
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
199.122g/mol
XLogP3:
0
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
199.023g/mol
Monoisotopic Mass:
199.023g/mol
Topological Polar Surface Area:
112A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
372
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



1-Methyl-3,5-dinitro-1H-pyridin-2-one is a versatile compound commonly employed in chemical synthesis for its unique reactivity and functional group compatibility. This compound serves as a valuable building block in the preparation of various complex organic molecules due to its ability to undergo diverse transformations under mild reaction conditions. Specifically, 1-Methyl-3,5-dinitro-1H-pyridin-2-one is utilized as a key intermediate in the synthesis of heterocyclic compounds, pharmaceuticals, agrochemicals, and other fine chemicals. Its presence in the synthesis pathway enables the selective introduction of nitro and carbonyl functionalities, facilitating the creation of structurally intricate molecules with tailored properties. Additionally, the electron-withdrawing nature of the nitro groups present in this compound enhances its utility in reactions involving aromatic substrates, providing avenues for regioselective transformations and functional group interconversions. Overall, the strategic incorporation of 1-Methyl-3,5-dinitro-1H-pyridin-2-one in chemical synthesis enables the efficient construction of complex molecular architectures with high structural diversity and synthetic efficiency.