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CAS 1171918-93-6

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3-Iodo-5-methoxy-6-(trifluoromethyl)-1H-indole

Description:
3-Iodo-5-methoxy-6-(trifluoromethyl)-1H-indole is a chemical compound that belongs to the indole family, characterized by its bicyclic structure containing a fused benzene and pyrrole ring. This compound features several notable substituents: an iodine atom at the 3-position, a methoxy group (-OCH3) at the 5-position, and a trifluoromethyl group (-CF3) at the 6-position of the indole ring. These substituents significantly influence the compound's chemical properties, including its reactivity, polarity, and potential biological activity. The presence of the trifluoromethyl group often enhances lipophilicity and can affect the compound's interaction with biological targets. Additionally, the iodine atom can participate in various chemical reactions, such as nucleophilic substitutions. This compound may be of interest in medicinal chemistry and materials science due to its unique structural features and potential applications in drug development or as a synthetic intermediate. However, specific properties such as solubility, melting point, and spectral data would require experimental determination or literature reference for precise values.
Formula:C10H7F3INO
InChI:InChI=1S/C10H7F3INO/c1-16-9-2-5-7(14)4-15-8(5)3-6(9)10(11,12)13/h2-4,15H,1H3
InChI key:InChIKey=XATNKZPTOXCYNE-UHFFFAOYSA-N
SMILES:IC=1C=2C(=CC(C(F)(F)F)=C(OC)C2)NC1
Synonyms:
  • 1H-Indole, 3-iodo-5-methoxy-6-(trifluoromethyl)-
  • 3-Iodo-5-methoxy-6-(trifluoromethyl)-1H-indole
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