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CAS 352018-89-4

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4-isocyanato-3-methyl-5-phenylisoxazole

Description:
4-Isocyanato-3-methyl-5-phenylisoxazole is a chemical compound characterized by its isocyanate functional group, which is known for its reactivity and ability to form urethane linkages. This compound features an isoxazole ring, a five-membered heterocyclic structure containing both nitrogen and oxygen, contributing to its unique chemical properties. The presence of a phenyl group and a methyl group on the isoxazole ring enhances its stability and influences its reactivity. Typically, isocyanates are utilized in the synthesis of polymers, particularly in the production of polyurethane foams and coatings. The compound's reactivity allows it to participate in various chemical reactions, including nucleophilic addition and polymerization. Safety considerations are paramount when handling isocyanates, as they can be irritants and pose health risks upon exposure. Overall, 4-isocyanato-3-methyl-5-phenylisoxazole is significant in organic synthesis and materials science, with potential applications in advanced materials and chemical intermediates.
Formula:C11H8N2O2
InChI:InChI=1/C11H8N2O2/c1-8-10(12-7-14)11(15-13-8)9-5-3-2-4-6-9/h2-6H,1H3
InChI key:InChIKey=ZSAPULDWGBONCI-UHFFFAOYSA-N
SMILES:N(=C=O)C1=C(ON=C1C)C2=CC=CC=C2
Synonyms:
  • 3-Methyl-5-phenylisoxazol-4-yl isocyanate
  • Isoxazole, 4-isocyanato-3-methyl-5-phenyl-
  • 4-Isocyanato-3-methyl-5-phenylisoxazole
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