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CAS 172876-96-9

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1,2-Benziodoxole-1(3H)-carbonitrile,3-oxo

Description:
1,2-Benziodoxole-1(3H)-carbonitrile, 3-oxo, identified by its CAS number 172876-96-9, is a chemical compound that features a unique structure combining a benziodoxole moiety with a carbonitrile and a ketone functional group. This compound is characterized by its heterocyclic ring system, which contributes to its reactivity and potential applications in organic synthesis. The presence of the carbonitrile group indicates that it can participate in nucleophilic reactions, while the ketone functionality may allow for further transformations, such as condensation or oxidation reactions. Additionally, the benziodoxole structure is known for its stability and ability to act as an electrophile, making it useful in various chemical reactions, including those involving oxidation. Overall, this compound is of interest in the field of synthetic organic chemistry, particularly for its potential utility in the development of new synthetic methodologies and the synthesis of complex organic molecules.
Formula:C8H4INO2
InChI:InChI=1/C8H4INO2/c10-5-9-7-4-2-1-3-6(7)8(11)12-9/h1-4H
SMILES:c1ccc2c(c1)C(=O)OI2C#N
Synonyms:
  • 7-Oxo-9$L^{3}-Ioda-8-Oxabicyclo[4.3.0]Nona-1,3,5-Triene-9-Carbonitrile
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