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CAS 898770-89-3

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Ethyl 4-(4-morpholinylmethyl)-η-oxobenzeneoctanoate

Description:
Ethyl 4-(4-morpholinylmethyl)-η-oxobenzeneoctanoate, identified by its CAS number 898770-89-3, is a chemical compound characterized by its complex structure, which includes an ethyl ester functional group and a morpholine moiety. This compound typically exhibits properties associated with both lipophilicity and hydrophilicity due to the presence of the long octanoate chain and the morpholine ring, which can influence its solubility in various solvents. The morpholine group may impart certain biological activities, making it of interest in pharmaceutical applications. Additionally, the presence of the η-oxobenzene structure suggests potential reactivity and interactions with other chemical species. The compound's molecular weight, boiling point, melting point, and specific reactivity would depend on its precise structural configuration and the conditions under which it is studied. Overall, this compound's unique characteristics make it a subject of interest in both synthetic chemistry and potential medicinal chemistry applications.
Formula:C21H31NO4
InChI:InChI=1S/C21H31NO4/c1-2-26-21(24)8-6-4-3-5-7-20(23)19-11-9-18(10-12-19)17-22-13-15-25-16-14-22/h9-12H,2-8,13-17H2,1H3
InChI key:InChIKey=JJKNDZMDMTYGQR-UHFFFAOYSA-N
SMILES:C(C1=CC=C(C(CCCCCCC(OCC)=O)=O)C=C1)N2CCOCC2
Synonyms:
  • Ethyl 4-(4-morpholinylmethyl)-η-oxobenzeneoctanoate
  • Benzeneoctanoic acid, 4-(4-morpholinylmethyl)-η-oxo-, ethyl ester
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