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CAS 905966-41-8

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2-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]acetonitrile

Description:
2-[4-(5,5-Dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]acetonitrile, with the CAS number 905966-41-8, is an organic compound characterized by its unique structure that includes a phenyl group substituted with a dioxaborinane moiety and an acetonitrile functional group. This compound typically exhibits properties associated with both aromatic and boron-containing compounds, which may influence its reactivity and stability. The presence of the dioxaborinane ring suggests potential applications in organic synthesis and materials science, particularly in the development of boron-containing ligands or catalysts. Additionally, the acetonitrile group may impart polar characteristics, affecting solubility in various solvents. The compound's molecular structure allows for potential interactions in biological systems, making it of interest in medicinal chemistry. Overall, its unique combination of functional groups positions it as a versatile compound in both synthetic and applied chemistry contexts.
Formula:C13H16BNO2
InChI:InChI=1/C13H16BNO2/c1-13(2)9-16-14(17-10-13)12-5-3-11(4-6-12)7-8-15/h3-6H,7,9-10H2,1-2H3
SMILES:CC1(C)COB(c2ccc(cc2)CC#N)OC1
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