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CAS 898763-87-6

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4-[4-(2,5-dihydropyrrol-1-ylmethyl)benzoyl]benzonitrile

Description:
4-[4-(2,5-Dihydropyrrol-1-ylmethyl)benzoyl]benzonitrile, with the CAS number 898763-87-6, is a synthetic organic compound characterized by its complex molecular structure, which includes a benzoyl group and a benzonitrile moiety. This compound features a dihydropyrrole ring, contributing to its potential biological activity and interactions. It is typically a solid at room temperature and may exhibit moderate solubility in organic solvents, depending on the specific conditions. The presence of both aromatic and heterocyclic components suggests that it may engage in π-π stacking interactions and hydrogen bonding, which can influence its reactivity and stability. Additionally, the nitrile functional group may impart unique electronic properties, making it a candidate for various applications in medicinal chemistry and material science. Its synthesis and characterization would involve standard organic chemistry techniques, and it may be of interest in the development of pharmaceuticals or agrochemicals due to its structural features.
Formula:C19H16N2O
InChI:InChI=1/C19H16N2O/c20-13-15-3-7-17(8-4-15)19(22)18-9-5-16(6-10-18)14-21-11-1-2-12-21/h1-10H,11-12,14H2
SMILES:C1=CCN(C1)Cc1ccc(cc1)C(=O)c1ccc(cc1)C#N
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