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CAS 951886-81-0

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Ethyl 5-chloro-2-methoxy-η-oxobenzeneoctanoate

Description:
Ethyl 5-chloro-2-methoxy-η-oxobenzeneoctanoate, identified by its CAS number 951886-81-0, is a chemical compound that belongs to the class of esters. This substance features a benzene ring substituted with a chlorine atom and a methoxy group, contributing to its unique reactivity and properties. The presence of the ethyl ester functional group indicates that it can participate in various chemical reactions, such as hydrolysis and transesterification. The compound's structure suggests it may exhibit moderate lipophilicity, which can influence its solubility in organic solvents and its potential applications in pharmaceuticals or agrochemicals. Additionally, the chlorine and methoxy substituents can affect the compound's electronic properties, potentially impacting its biological activity. As with many organic compounds, safety and handling precautions should be observed, as the specific toxicity and environmental impact of this compound would need to be assessed through appropriate studies. Overall, Ethyl 5-chloro-2-methoxy-η-oxobenzeneoctanoate presents interesting characteristics for further exploration in chemical research and applications.
Formula:C17H23ClO4
InChI:InChI=1S/C17H23ClO4/c1-3-22-17(20)9-7-5-4-6-8-15(19)14-12-13(18)10-11-16(14)21-2/h10-12H,3-9H2,1-2H3
InChI key:InChIKey=NTBVBYKCPCCRQE-UHFFFAOYSA-N
SMILES:C(CCCCCCC(OCC)=O)(=O)C1=C(OC)C=CC(Cl)=C1
Synonyms:
  • Benzeneoctanoic acid, 5-chloro-2-methoxy-η-oxo-, ethyl ester
  • Ethyl 5-chloro-2-methoxy-η-oxobenzeneoctanoate
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