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CAS 898783-38-5

:

ethyl 5-oxo-5-[4-(thiomorpholinomethyl)phenyl]pentanoate

Description:
Ethyl 5-oxo-5-[4-(thiomorpholinomethyl)phenyl]pentanoate, identified by its CAS number 898783-38-5, is a synthetic organic compound characterized by its complex molecular structure. It features an ethyl ester functional group, which contributes to its solubility in organic solvents and potential reactivity in various chemical reactions. The presence of a 5-oxo group indicates a ketone functionality, which can participate in nucleophilic addition reactions. Additionally, the compound contains a thiomorpholine moiety, which introduces a sulfur atom into the structure, potentially influencing its biological activity and interaction with other molecules. The phenyl group attached to the thiomorpholine adds aromatic characteristics, enhancing the compound's stability and reactivity. Overall, this compound may exhibit interesting pharmacological properties, making it a candidate for further research in medicinal chemistry. Its specific characteristics, such as melting point, boiling point, and spectral data, would require experimental determination or literature reference for precise values.
Formula:C18H25NO3S
InChI:InChI=1/C18H25NO3S/c1-2-22-18(21)5-3-4-17(20)16-8-6-15(7-9-16)14-19-10-12-23-13-11-19/h6-9H,2-5,10-14H2,1H3
InChI key:InChIKey=SQPFTGXBNUGMKG-UHFFFAOYSA-N
SMILES:C(C1=CC=C(C(CCCC(OCC)=O)=O)C=C1)N2CCSCC2
Synonyms:
  • Benzenepentanoic acid, δ-oxo-4-(4-thiomorpholinylmethyl)-, ethyl ester
  • Ethyl δ-oxo-4-(4-thiomorpholinylmethyl)benzenepentanoate
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