CAS 898786-54-4
:2-Methoxy-ζ-oxobenzeneheptanenitrile
Description:
2-Methoxy-ζ-oxobenzeneheptanenitrile, identified by its CAS number 898786-54-4, is a chemical compound that features a complex structure characterized by the presence of a methoxy group, a ketone functional group, and a nitrile group. The methoxy group (-OCH₃) contributes to the compound's polarity and can influence its solubility in organic solvents. The nitrile group (-C≡N) is known for its ability to participate in various chemical reactions, including nucleophilic additions and cycloadditions, making the compound potentially useful in synthetic organic chemistry. The presence of the benzene ring provides aromatic stability and can affect the compound's reactivity and interaction with other molecules. Additionally, the heptane chain indicates a moderate hydrophobic character, which may influence the compound's behavior in biological systems or its application in materials science. Overall, this compound's unique combination of functional groups suggests potential utility in pharmaceuticals, agrochemicals, or as an intermediate in organic synthesis.
Formula:C14H17NO2
InChI:InChI=1S/C14H17NO2/c1-17-14-10-6-5-8-12(14)13(16)9-4-2-3-7-11-15/h5-6,8,10H,2-4,7,9H2,1H3
InChI key:InChIKey=PKKAIPOHAPNEDV-UHFFFAOYSA-N
SMILES:C(CCCCCC#N)(=O)C1=C(OC)C=CC=C1
Synonyms:- 2-Methoxy-ζ-oxobenzeneheptanenitrile
- Benzeneheptanenitrile, 2-methoxy-ζ-oxo-
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