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CAS 94094-27-6

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2-Propenoic acid, 3-[6-(4-methylbenzoyl)-2-pyridinyl]-, (E)-

Description:
2-Propenoic acid, 3-[6-(4-methylbenzoyl)-2-pyridinyl]-, (E)-, also known by its CAS number 94094-27-6, is an organic compound characterized by its structure, which includes a propenoic acid moiety and a pyridine ring substituted with a 4-methylbenzoyl group. This compound typically exhibits properties associated with both carboxylic acids and aromatic compounds, such as acidity and potential for hydrogen bonding. The (E)- configuration indicates that the substituents around the double bond are on opposite sides, which can influence its reactivity and interactions with other molecules. It is likely to be soluble in organic solvents and may have limited solubility in water due to the hydrophobic aromatic groups. The presence of the pyridine ring suggests potential applications in pharmaceuticals or as a building block in organic synthesis, particularly in the development of materials or intermediates in chemical reactions. Overall, this compound's unique structure may confer specific biological or chemical activities worth exploring in research and industrial applications.
Formula:C16H13NO3
InChI:InChI=1S/C16H13NO3/c1-11-5-7-12(8-6-11)16(20)14-4-2-3-13(17-14)9-10-15(18)19/h2-10H,1H3,(H,18,19)/b10-9+
InChI key:InChIKey=USGBEAJEZNVPAG-MDZDMXLPSA-N
SMILES:C(=O)(C=1N=C(/C=C/C(O)=O)C=CC1)C2=CC=C(C)C=C2
Synonyms:
  • (2E)-3-[6-(4-methylbenzoyl)pyridin-2-yl]prop-2-enoic acid
  • 2-Propenoic acid, 3-[6-(4-methylbenzoyl)-2-pyridinyl]-, (E)-
  • (E)-3-(6-(p-Toluoyl)-2-pyridyl)acrylic acid
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