CAS 5205-40-3
:Ethyl 5-oxooctanoate
Description:
Ethyl 5-oxooctanoate, with the CAS number 5205-40-3, is an ester derived from octanoic acid and ethanol. It is characterized by its molecular structure, which includes a carbon chain of eight carbon atoms with a ketone functional group at the fifth position. This compound typically appears as a colorless to pale yellow liquid with a fruity odor, making it potentially useful in flavoring and fragrance applications. Ethyl 5-oxooctanoate is soluble in organic solvents but has limited solubility in water due to its hydrophobic carbon chain. Its chemical properties include reactivity typical of esters, such as hydrolysis in the presence of acids or bases, which can lead to the formation of the corresponding acid and alcohol. Additionally, it may undergo various reactions, including oxidation and reduction, depending on the conditions. Safety data indicates that, like many esters, it should be handled with care, as it may cause irritation upon contact with skin or eyes. Overall, ethyl 5-oxooctanoate is a versatile compound with applications in the food and fragrance industries.
Formula:C10H18O3
InChI:InChI=1S/C10H18O3/c1-3-6-9(11)7-5-8-10(12)13-4-2/h3-8H2,1-2H3
InChI key:InChIKey=PNHVXYJIXFZRGA-UHFFFAOYSA-N
SMILES:C(CCCC(OCC)=O)(CCC)=O
Synonyms:- Octanoic acid, 5-oxo-, ethyl ester
- Ethyl 5-oxooctanoate
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