CAS 898759-89-2
:3-(2-Oxazolylcarbonyl)benzonitrile
Description:
3-(2-Oxazolylcarbonyl)benzonitrile, with the CAS number 898759-89-2, is an organic compound characterized by its unique structural features. It contains a benzonitrile moiety, which is a benzene ring substituted with a nitrile group, and a 2-oxazolylcarbonyl group, indicating the presence of an oxazole ring fused with a carbonyl functional group. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents due to its polar functional groups. The presence of the oxazole ring suggests potential biological activity, as oxazole derivatives are often explored in medicinal chemistry. Additionally, the nitrile group can participate in various chemical reactions, making this compound versatile for synthetic applications. Its molecular structure may contribute to specific electronic properties, influencing its reactivity and interactions with other molecules. Overall, 3-(2-Oxazolylcarbonyl)benzonitrile is of interest in both academic research and potential industrial applications, particularly in the fields of pharmaceuticals and materials science.
Formula:C11H6N2O2
InChI:InChI=1S/C11H6N2O2/c12-7-8-2-1-3-9(6-8)10(14)11-13-4-5-15-11/h1-6H
InChI key:InChIKey=BSLKKDUMCRMAIB-UHFFFAOYSA-N
SMILES:C(=O)(C1=CC(C#N)=CC=C1)C2=NC=CO2
Synonyms:- Benzonitrile, 3-(2-oxazolylcarbonyl)-
- 3-(2-Oxazolylcarbonyl)benzonitrile
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