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CAS 898793-69-6

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4-[3-(2,4-dimethylphenyl)propanoyl]benzonitrile

Description:
4-[3-(2,4-Dimethylphenyl)propanoyl]benzonitrile, with the CAS number 898793-69-6, is an organic compound characterized by its complex structure, which includes a benzonitrile moiety and a propanoyl group attached to a dimethyl-substituted phenyl ring. This compound typically exhibits properties common to aromatic nitriles, such as moderate solubility in organic solvents and potential reactivity due to the presence of the nitrile functional group. The presence of the dimethylphenyl group may influence its electronic properties and steric hindrance, affecting its reactivity and interactions with other molecules. Additionally, compounds of this nature may have applications in pharmaceuticals or materials science, depending on their specific chemical behavior and biological activity. The molecular structure suggests potential for various intermolecular interactions, including hydrogen bonding and π-π stacking, which could be relevant in solid-state properties or in solution. Overall, this compound represents a class of organic molecules with diverse applications based on their unique structural characteristics.
Formula:C18H17NO
InChI:InChI=1/C18H17NO/c1-13-3-6-16(14(2)11-13)9-10-18(20)17-7-4-15(12-19)5-8-17/h3-8,11H,9-10H2,1-2H3
SMILES:Cc1ccc(CCC(=O)c2ccc(cc2)C#N)c(C)c1
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