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CAS 2051-95-8

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3-Benzoylpropionic acid

Description:
3-Benzoylpropionic acid, with the CAS number 2051-95-8, is an organic compound characterized by its structure, which features a propionic acid backbone with a benzoyl group attached at the third carbon. This compound typically appears as a white to off-white crystalline solid and is soluble in organic solvents such as ethanol and acetone, but has limited solubility in water. It possesses both acidic and aromatic properties, making it a versatile intermediate in organic synthesis. The presence of the carboxylic acid functional group contributes to its acidity, while the benzoyl moiety enhances its reactivity in various chemical reactions, including acylation and esterification. 3-Benzoylpropionic acid is often utilized in the synthesis of pharmaceuticals, agrochemicals, and other fine chemicals. Additionally, it may exhibit biological activity, which can be of interest in medicinal chemistry. Proper handling and storage are essential due to its potential irritant properties.
Formula:C10H10O3
InChI:InChI=1S/C10H10O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13)
InChI key:InChIKey=KMQLIDDEQAJAGJ-UHFFFAOYSA-N
SMILES:C(CCC(O)=O)(=O)C1=CC=CC=C1
Synonyms:
  • 2-(3-Carboxyphenyl) Propionic Acid
  • 3-Benzoylpropanoic acid
  • 3-Phenoxypropanoic Acid
  • 4-Oxo-4-Phenylbutanoate
  • 4-Oxo-4-Phenylbutanoic Acid
  • 4-Oxo-4-phenylbutyric acid
  • 4-Phenyl-4-oxobutanoic acid
  • Benzenebutanoic acid, γ-oxo-
  • Gamma-Oxo-Benzenebutanoic Acid
  • NSC 2092
  • See more synonyms
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