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CAS 52034-38-5

:

4-(3-Formyl-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid

Description:
4-(3-Formyl-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid, with the CAS number 52034-38-5, is an organic compound characterized by its complex structure that includes a benzoic acid moiety and a pyrrole derivative. This compound features a formyl group (-CHO) attached to a pyrrole ring, which is further substituted with two methyl groups at the 2 and 5 positions, enhancing its aromatic properties. The presence of the carboxylic acid functional group (-COOH) contributes to its acidity and potential for hydrogen bonding, making it soluble in polar solvents. The compound may exhibit interesting biological activities due to the pyrrole ring, which is known for its presence in various natural products and pharmaceuticals. Additionally, its structural features suggest potential applications in organic synthesis, materials science, and as a building block in the development of more complex molecules. Overall, this compound's unique characteristics make it a subject of interest in both academic and industrial research settings.
Formula:C14H13NO3
InChI:InChI=1S/C14H13NO3/c1-9-7-12(8-16)10(2)15(9)13-5-3-11(4-6-13)14(17)18/h3-8H,1-2H3,(H,17,18)
InChI key:InChIKey=GPYVXQQXXCPCGK-UHFFFAOYSA-N
SMILES:CC=1N(C(C)=CC1C=O)C2=CC=C(C(O)=O)C=C2
Synonyms:
  • 1-(4-Carboxyphenyl)-2,5-dimethyl-4-formylpyrrole
  • 4-(3-Formyl-2,5-dimethylpyrrol-1-yl)benzoic acid
  • NSC 242028
  • benzoic acid, 4-(3-formyl-2,5-dimethyl-1H-pyrrol-1-yl)-
  • 4-(3-Formyl-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
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