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CAS 1779-60-8

:

propyl acetoacetate

Description:
Propyl acetoacetate, with the CAS number 1779-60-8, is an organic compound classified as a beta-keto ester. It features a propyl group attached to the acetoacetate moiety, which consists of a ketone and an ester functional group. This compound is typically a colorless to pale yellow liquid with a fruity odor, making it useful in flavoring and fragrance applications. Propyl acetoacetate is soluble in organic solvents such as ethanol and ether but has limited solubility in water due to its hydrophobic propyl group. It is known for its reactivity in various chemical reactions, including Claisen condensation and Michael addition, making it valuable in synthetic organic chemistry. Additionally, it can serve as an intermediate in the synthesis of pharmaceuticals and agrochemicals. Safety data indicates that it should be handled with care, as it may cause irritation to the skin and eyes. Overall, propyl acetoacetate is a versatile compound with significant applications in both industrial and laboratory settings.
Formula:C7H12O3
InChI:InChI=1/C7H12O3/c1-3-4-10-7(9)5-6(2)8/h3-5H2,1-2H3
InChI key:InChIKey=DHGFMVMDBNLMKT-UHFFFAOYSA-N
SMILES:C(C(OCCC)=O)C(C)=O
Synonyms:
  • Acetoacetic Acid n-Propyl Ester
  • Acetoacetic acid, propyl ester
  • Acetoacetic n-propyl ester
  • Butanoic acid, 3-oxo-, propyl ester
  • NSC 42862
  • Propyl 3-Oxobutanoate
  • n-Propyl acetoacetate
  • Propyl acetoacetate
  • 3-oxo-butanoicacipropylester
  • 3-ketobutyric acid propyl ester
  • See more synonyms
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