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CAS 368869-87-8

:

7-isocyanato-3,4-dihydro-2H-1,5-benzodioxepine

Description:
7-Isocyanato-3,4-dihydro-2H-1,5-benzodioxepine is a chemical compound characterized by its unique bicyclic structure, which includes a benzodioxepine core and an isocyanate functional group. The presence of the isocyanate group (-N=C=O) indicates that this compound can participate in nucleophilic addition reactions, making it a potential intermediate in organic synthesis. The bicyclic nature of the compound contributes to its stability and reactivity, allowing it to engage in various chemical transformations. This compound may exhibit properties typical of isocyanates, such as being reactive towards amines and alcohols, which can lead to the formation of ureas and carbamates, respectively. Additionally, due to the presence of the dioxepine ring, it may also display interesting pharmacological properties, although specific biological activity would require further investigation. Safety considerations are important, as isocyanates are known to be toxic and can cause respiratory irritation. Overall, 7-isocyanato-3,4-dihydro-2H-1,5-benzodioxepine is a compound of interest in synthetic chemistry and materials science.
Formula:C10H9NO3
InChI:InChI=1/C10H9NO3/c12-7-11-8-2-3-9-10(6-8)14-5-1-4-13-9/h2-3,6H,1,4-5H2
SMILES:C1COc2ccc(cc2OC1)N=C=O
Synonyms:
  • 2H-1,5-benzodioxepin, 3,4-dihydro-7-isocyanato-
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