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CAS 81630-84-4

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5-Propoxy-1H-indole-3-acetonitrile

Description:
5-Propoxy-1H-indole-3-acetonitrile is a chemical compound characterized by its indole structure, which is a bicyclic compound consisting of a benzene ring fused to a pyrrole ring. This particular compound features a propoxy group at the 5-position and an acetonitrile group at the 3-position of the indole ring. It is typically a solid or liquid at room temperature, depending on its purity and specific conditions. The presence of the propoxy group contributes to its hydrophobic characteristics, while the acetonitrile moiety introduces polar properties, potentially influencing its solubility in various solvents. This compound may exhibit biological activity, making it of interest in pharmaceutical research, particularly in the development of new drugs or as a biochemical probe. Its synthesis and reactivity can be influenced by the functional groups present, allowing for various chemical transformations. As with many organic compounds, safety precautions should be taken when handling it, as it may pose health risks or environmental hazards.
Formula:C13H14N2O
InChI:InChI=1S/C13H14N2O/c1-2-7-16-11-3-4-13-12(8-11)10(5-6-14)9-15-13/h3-4,8-9,15H,2,5,7H2,1H3
InChI key:InChIKey=RLZXDTGKUKBHMJ-UHFFFAOYSA-N
SMILES:C(C#N)C=1C=2C(NC1)=CC=C(OCCC)C2
Synonyms:
  • 2-(5-Propoxy-1H-indol-3-yl)acetonitrile
  • 5-Propoxy-1H-indole-3-acetonitrile
  • 1H-Indole-3-acetonitrile, 5-propoxy-
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