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CAS 261350-48-5

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Methyl 4-methyl-5-isoxazolecarboxylate

Description:
Methyl 4-methyl-5-isoxazolecarboxylate is a chemical compound characterized by its isoxazole ring structure, which is a five-membered heterocyclic compound containing both nitrogen and oxygen. This substance typically appears as a colorless to pale yellow liquid and is known for its distinctive odor. It is soluble in organic solvents such as ethanol and acetone but has limited solubility in water. The compound is primarily used in organic synthesis and may serve as an intermediate in the production of pharmaceuticals and agrochemicals. Its reactivity is influenced by the presence of the carboxylate group, which can participate in various chemical reactions, including esterification and nucleophilic substitutions. Safety data indicates that, like many organic compounds, it should be handled with care, as it may pose health risks if inhaled or ingested. Proper safety protocols, including the use of personal protective equipment, are recommended when working with this substance in a laboratory setting.
Formula:C6H7NO3
InChI:InChI=1S/C6H7NO3/c1-4-3-7-10-5(4)6(8)9-2/h3H,1-2H3
InChI key:InChIKey=BZGHKIIGKXOGCF-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(C)C=NO1
Synonyms:
  • Methyl 4-methyl-5-isoxazolecarboxylate
  • 5-Isoxazolecarboxylic acid, 4-methyl-, methyl ester
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