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CAS 898757-75-0

:

Ethyl 4-(1-methylethoxy)-ζ-oxobenzeneheptanoate

Description:
Ethyl 4-(1-methylethoxy)-ζ-oxobenzeneheptanoate, identified by its CAS number 898757-75-0, is an organic compound that belongs to the class of esters. This substance features a complex structure characterized by the presence of a benzene ring substituted with an ethoxy group and a heptanoate moiety. The ethyl group contributes to its ester functionality, while the methylethoxy group enhances its hydrophobic characteristics. Typically, compounds of this nature exhibit moderate to low solubility in water but are more soluble in organic solvents, making them useful in various applications, including as intermediates in organic synthesis or in the formulation of fragrances and flavorings. The presence of the oxo group suggests potential reactivity, which could be exploited in further chemical transformations. Additionally, the compound may exhibit specific biological activities, although detailed studies would be necessary to elucidate its pharmacological properties. As with many organic compounds, safety data and handling precautions should be considered when working with this substance in a laboratory setting.
Formula:C18H26O4
InChI:InChI=1S/C18H26O4/c1-4-21-18(20)9-7-5-6-8-17(19)15-10-12-16(13-11-15)22-14(2)3/h10-14H,4-9H2,1-3H3
InChI key:InChIKey=JQAWSPIQJGJYHZ-UHFFFAOYSA-N
SMILES:C(CCCCCC(OCC)=O)(=O)C1=CC=C(OC(C)C)C=C1
Synonyms:
  • Ethyl 4-(1-methylethoxy)-ζ-oxobenzeneheptanoate
  • Benzeneheptanoic acid, 4-(1-methylethoxy)-ζ-oxo-, ethyl ester
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