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CAS 1186405-05-9

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5-Nitro-6-(trifluoromethyl)-1H-indole

Description:
5-Nitro-6-(trifluoromethyl)-1H-indole is an organic compound characterized by its indole structure, which consists of a fused benzene and pyrrole ring. The presence of a nitro group (-NO2) at the 5-position and a trifluoromethyl group (-CF3) at the 6-position significantly influences its chemical properties and reactivity. This compound is typically a solid at room temperature and exhibits moderate solubility in organic solvents. The trifluoromethyl group enhances lipophilicity and can affect the compound's biological activity, making it of interest in medicinal chemistry and drug development. The nitro group can participate in various chemical reactions, including reduction and nucleophilic substitution. Additionally, the compound may exhibit interesting electronic properties due to the electron-withdrawing nature of the trifluoromethyl group and the electron-donating characteristics of the indole moiety. Overall, 5-Nitro-6-(trifluoromethyl)-1H-indole is a valuable compound for research in organic synthesis and potential pharmaceutical applications.
Formula:C9H5F3N2O2
InChI:InChI=1S/C9H5F3N2O2/c10-9(11,12)6-4-7-5(1-2-13-7)3-8(6)14(15)16/h1-4,13H
InChI key:InChIKey=RPVSQSQWFUXBNX-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=C(N(=O)=O)C=C2C(=C1)NC=C2
Synonyms:
  • 1H-Indole, 5-nitro-6-(trifluoromethyl)-
  • 5-Nitro-6-(trifluoromethyl)-1H-indole
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