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CAS 898780-97-7

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Ethyl 4-[3-[4-(methylthio)phenyl]-1-oxopropyl]benzoate

Description:
Ethyl 4-[3-[4-(methylthio)phenyl]-1-oxopropyl]benzoate, identified by its CAS number 898780-97-7, is an organic compound that belongs to the class of esters. This substance features a benzoate moiety, which is characterized by a benzene ring attached to a carboxylate group, and it includes an ethyl group that contributes to its ester functionality. The compound also contains a propanoyl group substituted with a methylthio group, which introduces sulfur into its structure, potentially affecting its reactivity and solubility. Ethyl 4-[3-[4-(methylthio)phenyl]-1-oxopropyl]benzoate may exhibit interesting biological activities due to its complex structure, making it a candidate for research in medicinal chemistry. Its physical properties, such as melting point, boiling point, and solubility, would depend on the specific interactions of its functional groups. As with many organic compounds, safety data and handling precautions should be considered, particularly regarding its potential toxicity and environmental impact.
Formula:C19H20O3S
InChI:InChI=1S/C19H20O3S/c1-3-22-19(21)16-9-7-15(8-10-16)18(20)13-6-14-4-11-17(23-2)12-5-14/h4-5,7-12H,3,6,13H2,1-2H3
InChI key:InChIKey=SVCYLMPRLYOMMC-UHFFFAOYSA-N
SMILES:C(CCC1=CC=C(SC)C=C1)(=O)C2=CC=C(C(OCC)=O)C=C2
Synonyms:
  • Ethyl 4-[3-[4-(methylthio)phenyl]-1-oxopropyl]benzoate
  • Benzoic acid, 4-[3-[4-(methylthio)phenyl]-1-oxopropyl]-, ethyl ester
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