Products 541-50-4

CAS 541-50-4 appears in our catalog under these names: Acetoacetic acid, 95.0%, Acetoacetic Acid. Offered by: MedChemExpress, Chemat Brand. Available pack sizes: 1 mg, 5 mg, 25 mg, 10 mg, on request.

Structural formula: {0} (CAS {1})

Acetoacetic acid is a 3-oxo monocarboxylic acid that is butyric acid bearing a 3-oxo substituent. It has a role as a metabolite. It is a 3-oxo fatty acid and a ketone body. It is functionally related to a butyric acid. It is a conjugate acid of an acetoacetate. It is a tautomer of a 3-hydroxy-3-butenoic acid.

Source: ChEBI

Identity
Molecular formulaC4H6O3
Molecular weight102.09 g/mol
IUPAC name3-oxobutanoic acid
InChIKeyWDJHALXBUFZDSR-UHFFFAOYSA-N
SMILESCC(=O)CC(=O)O

Computed by PubChem (NCBI)