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CAS 268748-84-1

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4-isocyanato-5-methyl-3-phenylisoxazole

Description:
4-Isocyanato-5-methyl-3-phenylisoxazole is a chemical compound characterized by its isocyanate functional group, which is known for its reactivity, particularly in forming urethanes and other derivatives. This compound features a five-membered isoxazole ring, which contributes to its unique chemical properties, including potential applications in pharmaceuticals and materials science. The presence of the methyl and phenyl groups enhances its hydrophobic characteristics and may influence its biological activity. As an isocyanate, it is important to handle this substance with care due to its potential toxicity and irritant properties, particularly to the respiratory system and skin. The compound's reactivity allows it to participate in various chemical reactions, making it a valuable intermediate in organic synthesis. Additionally, its structural features may provide insights into its potential applications in developing new materials or therapeutic agents. Proper safety measures should be observed when working with this compound, given the hazards associated with isocyanates.
Formula:C11H8N2O2
InChI:InChI=1/C11H8N2O2/c1-8-10(12-7-14)11(13-15-8)9-5-3-2-4-6-9/h2-6H,1H3
SMILES:Cc1c(c(c2ccccc2)no1)N=C=O
Synonyms:
  • 4-Isocyanato-5-methyl-3-phenyl-1,2-oxazole
  • Isoxazole, 4-Isocyanato-5-Methyl-3-Phenyl-
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