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CAS 2941-66-4

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2-Methyl-5-nitrobenzothiazole

Description:
2-Methyl-5-nitrobenzothiazole is an organic compound characterized by its benzothiazole structure, which consists of a benzene ring fused to a thiazole ring. This compound features a methyl group at the 2-position and a nitro group at the 5-position of the benzothiazole framework. It is typically a yellow to orange crystalline solid, exhibiting moderate solubility in organic solvents. The presence of the nitro group contributes to its potential reactivity and makes it a candidate for various chemical reactions, including nucleophilic substitutions. 2-Methyl-5-nitrobenzothiazole is often used in the synthesis of dyes, pharmaceuticals, and agrochemicals due to its unique electronic properties and ability to participate in further chemical transformations. Additionally, it may exhibit biological activity, making it of interest in medicinal chemistry. As with many nitro compounds, it is important to handle it with care due to potential toxicity and environmental concerns. Proper safety measures should be observed when working with this substance in laboratory settings.
Formula:C8H6N2O2S
InChI:InChI=1S/C8H6N2O2S/c1-5-9-7-4-6(10(11)12)2-3-8(7)13-5/h2-4H,1H3
InChI key:InChIKey=VEWGTWPJKSPGCD-UHFFFAOYSA-N
SMILES:N(=O)(=O)C=1C=C2C(=CC1)SC(C)=N2
Synonyms:
  • 2-Methyl-5-Nitro-1,3-Benzothiazole
  • Benzothiazole, 2-methyl-5-nitro-
  • 2-Methyl-5-nitrobenzothiazole
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