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CAS 898790-51-7

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Ethyl 3-[3-(3-methylphenyl)-1-oxopropyl]benzoate

Description:
Ethyl 3-[3-(3-methylphenyl)-1-oxopropyl]benzoate, identified by its CAS number 898790-51-7, is an organic compound that belongs to the class of esters. This substance features a benzoate moiety, indicating the presence of a benzoic acid derivative, and an ethyl group, which contributes to its ester characteristics. The compound contains a propyl chain with a ketone functional group, which is attached to a phenyl ring that is further substituted with a methyl group, enhancing its aromatic properties. Ethyl 3-[3-(3-methylphenyl)-1-oxopropyl]benzoate is likely to exhibit moderate solubility in organic solvents and may have limited solubility in water due to its hydrophobic aromatic structure. Its molecular structure suggests potential applications in organic synthesis, pharmaceuticals, or as a fragrance component, although specific applications would depend on further research into its biological activity and reactivity. Safety data and handling precautions should be consulted, as with any chemical substance, to ensure proper usage and minimize risks.
Formula:C19H20O3
InChI:InChI=1/C19H20O3/c1-3-22-19(21)17-9-5-8-16(13-17)18(20)11-10-15-7-4-6-14(2)12-15/h4-9,12-13H,3,10-11H2,1-2H3
InChI key:InChIKey=HTEBPGOMNASESW-UHFFFAOYSA-N
SMILES:C(CCC1=CC(C)=CC=C1)(=O)C2=CC(C(OCC)=O)=CC=C2
Synonyms:
  • Ethyl 3-[3-(3-methylphenyl)-1-oxopropyl]benzoate
  • Benzoic acid, 3-[3-(3-methylphenyl)-1-oxopropyl]-, ethyl ester
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