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CAS 13283-91-5

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3-Oxooctanoic acid

Description:
3-Oxooctanoic acid, also known as 3-oxo-caprylic acid, is a medium-chain fatty acid characterized by its carboxylic acid functional group and a ketone group at the third carbon position of an eight-carbon chain. This compound typically appears as a colorless to pale yellow liquid or solid, depending on the temperature and purity. It is soluble in organic solvents and exhibits limited solubility in water due to its hydrophobic alkyl chain. The presence of both the carboxylic acid and ketone functional groups imparts unique chemical reactivity, allowing it to participate in various organic reactions, including esterification and acylation. 3-Oxooctanoic acid is of interest in biochemical research and industrial applications, particularly in the synthesis of surfactants, emulsifiers, and other chemical intermediates. Additionally, it may play a role in metabolic pathways, particularly in the context of fatty acid metabolism. Safety data indicates that, like many organic acids, it should be handled with care to avoid irritation to skin and mucous membranes.
Formula:C8H14O3
InChI:InChI=1S/C8H14O3/c1-2-3-4-5-7(9)6-8(10)11/h2-6H2,1H3,(H,10,11)
InChI key:InChIKey=FWNRRWJFOZIGQZ-UHFFFAOYSA-N
SMILES:C(C(CC(O)=O)=O)CCCC
Synonyms:
  • 3-Oxooctanoic acid
  • Octanoic acid, 3-oxo-
  • 3-Ketooctanoic acid
  • Octanoic acid, 3-oxo-
  • 3-Oxooctanoic acid
  • Caprylic acid, β-oxo-
  • β-Oxooctanoic acid
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