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CAS 41051-14-3

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Butanoic acid, 4-ethoxy-3-oxo-, ethyl ester

Description:
Butanoic acid, 4-ethoxy-3-oxo-, ethyl ester, identified by CAS number 41051-14-3, is an organic compound characterized by its ester functional group, which is derived from butanoic acid and an ethyl alcohol moiety. This compound typically exhibits a fruity odor, common to many esters, and is likely to be a colorless to pale yellow liquid at room temperature. It is soluble in organic solvents and may have limited solubility in water due to its hydrophobic ethyl group. The presence of the keto group (3-oxo) suggests that it may participate in various chemical reactions, including condensation and nucleophilic addition. Its structure indicates potential applications in the flavor and fragrance industry, as well as in organic synthesis. As with many esters, it may also exhibit moderate volatility and can be flammable. Safety data should be consulted for handling and storage, as it may pose health risks if inhaled or ingested.
Formula:C8H14O4
InChI:InChI=1S/C8H14O4/c1-3-11-6-7(9)5-8(10)12-4-2/h3-6H2,1-2H3
InChI key:InChIKey=RQCOPVYEHVOEMR-UHFFFAOYSA-N
SMILES:C(CC(OCC)=O)(COCC)=O
Synonyms:
  • Ethyl γ-ethoxyacetoacetate
  • Ethyl 4-ethoxyacetoacetate
  • Butanoic acid, 4-ethoxy-3-oxo-, ethyl ester
  • Acetoacetic acid, 4-ethoxy-, ethyl ester
  • Ethyl 4-ethoxy-3-oxobutanoate
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