CAS 898751-58-1
:Ethyl 3-methyl-η-oxobenzeneoctanoate
Description:
Ethyl 3-methyl-η-oxobenzeneoctanoate, identified by its CAS number 898751-58-1, is an organic compound that belongs to the class of esters. It features a structure that includes an ethyl group, a methyl group, and a benzene ring, along with an octanoate moiety. This compound is characterized by its relatively complex molecular structure, which contributes to its unique chemical properties. Typically, esters like this one are known for their pleasant fragrances and are often used in flavoring and fragrance applications. The presence of the benzene ring suggests potential aromatic characteristics, while the octanoate portion may impart fatty or oily properties. Ethyl 3-methyl-η-oxobenzeneoctanoate may exhibit moderate solubility in organic solvents and limited solubility in water, which is common for many esters. Its reactivity may include hydrolysis under certain conditions, leading to the formation of the corresponding acid and alcohol. Overall, this compound's specific applications and behavior would depend on its detailed chemical properties and interactions with other substances.
Formula:C17H24O3
InChI:InChI=1/C17H24O3/c1-3-20-17(19)12-7-5-4-6-11-16(18)15-10-8-9-14(2)13-15/h8-10,13H,3-7,11-12H2,1-2H3
InChI key:InChIKey=BGWBCDKEGRSFQL-UHFFFAOYSA-N
SMILES:C(CCCCCCC(OCC)=O)(=O)C1=CC(C)=CC=C1
Synonyms:- Benzeneoctanoic acid, 3-methyl-η-oxo-, ethyl ester
- Ethyl 3-methyl-η-oxobenzeneoctanoate
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