CAS 898767-21-0
:3-Fluoro-ε-oxobenzenehexanenitrile
Description:
3-Fluoro-ε-oxobenzenehexanenitrile is a chemical compound characterized by its unique structure, which includes a fluorine atom, a nitrile group, and a benzene ring. The presence of the fluorine atom typically imparts increased lipophilicity and can influence the compound's reactivity and biological activity. The nitrile functional group (-C≡N) is known for its ability to participate in various chemical reactions, including nucleophilic additions and cycloadditions. The compound's structure suggests it may exhibit interesting properties such as potential use in pharmaceuticals or agrochemicals, given the presence of both aromatic and aliphatic components. Additionally, the oxo group (carbonyl) contributes to its reactivity, making it a potential candidate for further chemical modifications. As with many fluorinated compounds, considerations regarding environmental impact and toxicity are essential, particularly in terms of persistence and bioaccumulation. Overall, 3-Fluoro-ε-oxobenzenehexanenitrile represents a complex molecule with potential applications in various fields of chemistry and materials science.
Formula:C12H12FNO
InChI:InChI=1S/C12H12FNO/c13-11-6-4-5-10(9-11)12(15)7-2-1-3-8-14/h4-6,9H,1-3,7H2
InChI key:InChIKey=MQZVCHPIZVFZJB-UHFFFAOYSA-N
SMILES:C(CCCCC#N)(=O)C1=CC(F)=CC=C1
Synonyms:- Benzenehexanenitrile, 3-fluoro-ε-oxo-
- 3-Fluoro-ε-oxobenzenehexanenitrile
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