CAS 125126-73-0

1-(2,4-Difluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxaldehyde

Description:

1-(2,4-Difluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxaldehyde is an organic compound characterized by its pyrrole ring structure, which is a five-membered aromatic heterocycle containing nitrogen. This compound features a carboxaldehyde functional group, contributing to its reactivity and potential applications in organic synthesis. The presence of the 2,4-difluorophenyl substituent indicates that it has two fluorine atoms attached to the phenyl ring, which can influence its electronic properties and lipophilicity. The two methyl groups at the 2 and 5 positions of the pyrrole ring enhance its steric bulk and may affect its interactions in biological systems. This compound may be of interest in medicinal chemistry and materials science due to its unique structural features, which could lead to specific biological activities or serve as a building block for more complex molecules. Its CAS number, 125126-73-0, allows for easy identification and retrieval of information regarding its properties, safety data, and potential applications in various fields.

Formula: C₁₃H₁₁F₂NO

InChI: InChI=1S/C13H11F2NO/c1-8-5-10(7-17)9(2)16(8)13-4-3-11(14)6-12(13)15/h3-7H,1-2H3

InChI key: InChIKey=MVDLNJHLFFSBDE-UHFFFAOYSA-N

SMILES: CC=1N(C(C)=CC1C=O)C2=C(F)C=C(F)C=C2

Synonyms:

• 1H-Pyrrole-3-carboxaldehyde, 1-(2,4-difluorophenyl)-2,5-dimethyl-
• 1-(2,4-Difluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxaldehyde
• 1-(2,4-Difluorophenyl)-2,5-dimethyl-1H-pyrrole-3-carbaldehyde