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CAS 885519-37-9

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6-Chloro-4-nitro-1H-indazole-3-carbonitrile

Description:
6-Chloro-4-nitro-1H-indazole-3-carbonitrile is a chemical compound characterized by its indazole core, which is a five-membered heterocyclic structure containing two nitrogen atoms. The presence of a chloro group at the 6-position and a nitro group at the 4-position contributes to its reactivity and potential applications in medicinal chemistry. The carbonitrile functional group at the 3-position enhances its polarity and may influence its biological activity. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its molecular structure suggests potential use in the development of pharmaceuticals, particularly in the field of anti-cancer or anti-inflammatory agents, due to the presence of functional groups that can participate in various chemical reactions. Additionally, the compound's unique combination of substituents may allow for specific interactions with biological targets, making it a subject of interest in drug discovery and development. Safety and handling precautions should be observed, as with many synthetic organic compounds, due to potential toxicity or reactivity.
Formula:C8H3ClN4O2
InChI:InChI=1S/C8H3ClN4O2/c9-4-1-5-8(6(3-10)12-11-5)7(2-4)13(14)15/h1-2H,(H,11,12)
InChI key:InChIKey=UGHXVZFALVMGAI-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=C2C(NN=C2C#N)=CC(Cl)=C1
Synonyms:
  • 1H-Indazole-3-carbonitrile, 6-chloro-4-nitro-
  • 6-Chloro-4-nitro-1H-indazole-3-carbonitrile
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