CAS 1092299-42-7

6-Chloro-β-oxo-1H-indole-3-propanenitrile

Description:

6-Chloro-β-oxo-1H-indole-3-propanenitrile is a chemical compound characterized by its indole structure, which is a bicyclic compound consisting of a benzene ring fused to a pyrrole ring. The presence of a chloro group at the 6-position and a β-oxo group contributes to its reactivity and potential biological activity. The propanenitrile moiety indicates the presence of a cyano group, which can enhance the compound's polarity and solubility in polar solvents. This compound may exhibit interesting pharmacological properties, making it a subject of interest in medicinal chemistry. Its synthesis typically involves multi-step organic reactions, and it may serve as an intermediate in the development of pharmaceuticals or agrochemicals. The compound's stability, solubility, and reactivity can be influenced by the functional groups present, and it may undergo various chemical transformations under different conditions. As with many indole derivatives, it may also exhibit fluorescence, which can be useful in biological imaging applications.

Formula: C₁₁H₇ClN₂O

InChI: InChI=1S/C11H7ClN2O/c12-7-1-2-8-9(11(15)3-4-13)6-14-10(8)5-7/h1-2,5-6,14H,3H2

InChI key: InChIKey=IVZYBUVHLPUYDV-UHFFFAOYSA-N

SMILES: C(CC#N)(=O)C=1C=2C(NC1)=CC(Cl)=CC2

Synonyms:

• 6-Chloro-β-oxo-1H-indole-3-propanenitrile
• 1H-Indole-3-propanenitrile, 6-chloro-β-oxo-