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CAS 27531-69-7

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3-Oxocyclooctanecarboxylic acid

Description:
3-Oxocyclooctanecarboxylic acid is a cyclic compound characterized by a cyclooctane ring with a carboxylic acid functional group and a ketone group. Its molecular structure features a total of eight carbon atoms arranged in a ring, with a carbonyl group (C=O) positioned at the 3rd carbon and a carboxylic acid group (-COOH) at the 1st carbon. This compound is typically a colorless to pale yellow solid and is soluble in organic solvents, reflecting its polar functional groups. The presence of both the ketone and carboxylic acid groups contributes to its reactivity, making it a potential intermediate in organic synthesis and a subject of interest in medicinal chemistry. Its unique structure allows for various chemical transformations, which can be exploited in the development of pharmaceuticals or agrochemicals. Additionally, the compound's properties, such as melting point and boiling point, can vary based on purity and environmental conditions, making it essential to refer to specific data for practical applications.
Formula:C9H14O3
InChI:InChI=1S/C9H14O3/c10-8-5-3-1-2-4-7(6-8)9(11)12/h7H,1-6H2,(H,11,12)
InChI key:InChIKey=BUWUDRMUXVLEJA-UHFFFAOYSA-N
SMILES:C(O)(=O)C1CC(=O)CCCCC1
Synonyms:
  • 3-Oxocyclooctanecarboxylic acid
  • 3-Oxocyclooctane-1-carboxylic acid
  • Cyclooctanecarboxylic acid, 3-oxo-
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