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CAS 72701-63-4

:

ethyl 2-chloro-3-cyano-6-methyl-5-nitroisonicotinate

Description:
Ethyl 2-chloro-3-cyano-6-methyl-5-nitroisonicotinate, with the CAS number 72701-63-4, is a chemical compound that belongs to the class of isonicotinates. This substance features a complex structure characterized by the presence of a chloro group, a cyano group, a nitro group, and an ethyl ester functional group. Its molecular structure suggests it may exhibit significant biological activity, potentially serving as a precursor in the synthesis of pharmaceuticals or agrochemicals. The presence of the nitro group often indicates potential for reactivity, while the cyano group can contribute to its polar nature, affecting solubility in various solvents. Additionally, the methyl group enhances the hydrophobic character of the molecule. Ethyl 2-chloro-3-cyano-6-methyl-5-nitroisonicotinate may also display interesting properties such as antimicrobial or herbicidal activity, making it a subject of interest in medicinal and agricultural chemistry. However, specific safety and handling guidelines should be followed due to the presence of potentially hazardous functional groups.
Formula:C10H8ClN3O4
InChI:InChI=1/C10H8ClN3O4/c1-3-18-10(15)7-6(4-12)9(11)13-5(2)8(7)14(16)17/h3H2,1-2H3
SMILES:CCOC(=O)c1c(C#N)c(Cl)nc(C)c1N(=O)=O
Synonyms:
  • Ethyl 2-Chloro-3-Cyano-6-Methyl-5-Nitropyridine-4-Carboxylate
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