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CAS 56816-01-4

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(+)-Ethyl 3-hydroxybutyrate

Description:
(+)-Ethyl 3-hydroxybutyrate, with the CAS number 56816-01-4, is an ester derived from the reaction of ethyl alcohol and 3-hydroxybutyric acid. This compound is characterized by its chiral nature, existing in the (+) configuration, which contributes to its specific optical activity. It is a colorless to pale yellow liquid with a fruity odor, making it appealing for use in flavoring and fragrance applications. The substance is soluble in organic solvents and exhibits moderate solubility in water. Its chemical structure features a hydroxyl group and an ester functional group, which contribute to its reactivity and potential applications in organic synthesis. Additionally, (+)-Ethyl 3-hydroxybutyrate is of interest in the field of biochemistry, particularly in metabolic studies, as it is involved in the synthesis of ketone bodies and may play a role in energy metabolism. Safety data indicates that, like many organic compounds, it should be handled with care, as it may cause irritation upon contact with skin or eyes.
Formula:C6H12O3
InChI:InChI=1S/C6H12O3/c1-3-9-6(8)4-5(2)7/h5,7H,3-4H2,1-2H3/t5-/m0/s1
InChI key:InChIKey=OMSUIQOIVADKIM-YFKPBYRVSA-N
SMILES:C(C(OCC)=O)[C@H](C)O
Synonyms:
  • (S)-(+)-Ethyl 3-hydroxybutyrate
  • Butanoic acid, 3-hydroxy-, ethyl ester, (3S)-
  • Ethyl (+)-3-hydroxybutanoate
  • Butanoic acid, 3-hydroxy-, ethyl ester, (S)-
  • Ethyl (S)-3-hydroxybutanoate
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