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CAS 3621-99-6

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2-(Methylthio)-6-nitrobenzothiazole

Description:
2-(Methylthio)-6-nitrobenzothiazole is an organic compound characterized by its unique structure, which includes a benzothiazole ring substituted with a methylthio group and a nitro group. This compound typically appears as a solid and is known for its potential applications in various fields, including pharmaceuticals and agrochemicals. The presence of the nitro group contributes to its reactivity and may influence its biological activity, while the methylthio group can enhance its lipophilicity, affecting its solubility and permeability. The compound is often studied for its potential as a building block in the synthesis of more complex molecules. Additionally, its chemical properties, such as melting point, boiling point, and solubility, can vary based on the specific conditions and purity of the sample. Safety data should be consulted, as compounds with nitro groups can sometimes exhibit hazardous properties. Overall, 2-(Methylthio)-6-nitrobenzothiazole represents a versatile structure in organic chemistry with implications for further research and development.
Formula:C8H6N2O2S2
InChI:InChI=1S/C8H6N2O2S2/c1-13-8-9-6-3-2-5(10(11)12)4-7(6)14-8/h2-4H,1H3
InChI key:InChIKey=UGURRSVQWLYDOY-UHFFFAOYSA-N
SMILES:N(=O)(=O)C=1C=C2C(N=C(SC)S2)=CC1
Synonyms:
  • 2-(Methylsulfanyl)-6-Nitro-1,3-Benzothiazole
  • 2-(Methylthio)-6-nitrobenzothiazole
  • 2-Methylsulfanyl-6-nitro-benzothiazole
  • Benzothiazole, 2-(methylthio)-6-nitro-
  • NSC 202563
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