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CAS 14618-10-1

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3H-1,2-Benzoxathiole, 5-nitro-, 2,2-dioxide

Description:
3H-1,2-Benzoxathiole, 5-nitro-, 2,2-dioxide, with CAS number 14618-10-1, is a heterocyclic organic compound characterized by its unique structure that includes a benzothiazole ring fused with a nitro group and a sulfone moiety. This compound typically exhibits a pale yellow to brownish appearance and is soluble in organic solvents, though its solubility in water is limited. The presence of the nitro group contributes to its potential reactivity and may influence its biological activity, making it of interest in various fields, including medicinal chemistry and materials science. The compound's stability can be affected by environmental conditions, such as pH and temperature, and it may undergo reduction or other chemical transformations under certain conditions. Its applications may include use as a synthetic intermediate or in the development of pharmaceuticals, where its unique electronic and steric properties can be leveraged. Safety data should be consulted for handling and potential toxicity, as compounds with nitro groups can sometimes exhibit hazardous characteristics.
Formula:C7H5NO5S
InChI:InChI=1/C7H5NO5S/c9-8(10)6-1-2-7-5(3-6)4-14(11,12)13-7/h1-3H,4H2
InChI key:InChIKey=NKGKZWZGRMZCMO-UHFFFAOYSA-N
SMILES:N(=O)(=O)C=1C=C2C(OS(=O)(=O)C2)=CC1
Synonyms:
  • 2-Hydroxy-5-nitro-α-toluenesulfonic acid sultone
  • 5-Nitro-2-hydroxytoluene-α-sulfonic acid sultone
  • 5-Nitro-3H-1,2-benzoxathiole 2,2-dioxide
  • 2-Hydroxy-5-nitrophenylmethanesulfonic acid sultone
  • 3H-1,2-Benzoxathiole, 5-nitro-, 2,2-dioxide
  • NSC 121602
  • 2-Hydroxy-5-nitro-alpha-toluenesulfonic acid sultone
  • 4-Hydroxy-5-nitrophenylmethanesulfonic acid sultone
  • AI3-61464
  • 5-nitro-3H-1,2λ
  • See more synonyms
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