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CAS 93866-50-3

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3-(phenylethynyl)benzoic acid

Description:
3-(Phenylethynyl)benzoic acid, with the CAS number 93866-50-3, is an organic compound characterized by its unique structure that includes a benzoic acid moiety and a phenylethynyl group. This compound typically appears as a solid at room temperature and is known for its aromatic properties due to the presence of multiple benzene rings. It is generally soluble in organic solvents such as ethanol and dimethyl sulfoxide, but may have limited solubility in water. The compound exhibits acidic behavior due to the carboxylic acid functional group, which can participate in hydrogen bonding and influence its reactivity. Additionally, 3-(phenylethynyl)benzoic acid is of interest in various fields, including materials science and medicinal chemistry, due to its potential applications in organic synthesis and as a building block for more complex molecules. Its unique structural features may also contribute to interesting photophysical properties, making it a candidate for studies in photochemistry and related disciplines.
Formula:C15H10O2
InChI:InChI=1/C15H10O2/c16-15(17)14-8-4-7-13(11-14)10-9-12-5-2-1-3-6-12/h1-8,11H,(H,16,17)
SMILES:c1ccc(cc1)C#Cc1cccc(c1)C(=O)O
Synonyms:
  • Benzoic acid, 3-(2-phenylethynyl)-
  • 3-(Phenylethynyl)benzoic acid
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