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CAS 845266-21-9

:

3-[2-(Methylthio)-5-nitrophenyl]-1H-pyrazole

Description:
3-[2-(Methylthio)-5-nitrophenyl]-1H-pyrazole, identified by its CAS number 845266-21-9, is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. This compound features a nitrophenyl group substituted at the 2-position with a methylthio group, contributing to its unique chemical properties. The presence of the nitro group typically imparts significant electron-withdrawing characteristics, influencing the compound's reactivity and potential applications in various chemical reactions. The methylthio group can enhance lipophilicity and may affect the compound's biological activity. As a pyrazole derivative, it may exhibit interesting pharmacological properties, making it a subject of interest in medicinal chemistry. The compound's solubility, stability, and reactivity can vary based on environmental conditions and the presence of other functional groups. Overall, 3-[2-(Methylthio)-5-nitrophenyl]-1H-pyrazole represents a versatile structure with potential applications in drug development and material science.
Formula:C10H9N3O2S
InChI:InChI=1S/C10H9N3O2S/c1-16-10-3-2-7(13(14)15)6-8(10)9-4-5-11-12-9/h2-6H,1H3,(H,11,12)
InChI key:InChIKey=OEXCWHTZQHSQPU-UHFFFAOYSA-N
SMILES:S(C)C1=C(C=C(N(=O)=O)C=C1)C=2C=CNN2
Synonyms:
  • 1H-Pyrazole, 3-[2-(methylthio)-5-nitrophenyl]-
  • 3-[2-(methylthio)-5-nitrophenyl]-1H-pyrazole
  • 3-[2-(Methylthio)-5-nitrophenyl]-1H-pyrazole
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