CAS 1135283-00-9

Methyl 1-methyl-4-(1-oxopropyl)-1H-pyrrole-2-carboxylate

Description:

Methyl 1-methyl-4-(1-oxopropyl)-1H-pyrrole-2-carboxylate is a chemical compound characterized by its pyrrole ring structure, which is a five-membered aromatic heterocycle containing nitrogen. This compound features a methyl group and a carboxylate ester functional group, contributing to its reactivity and solubility properties. The presence of the 1-oxopropyl substituent indicates that it has a ketone functional group, which can participate in various chemical reactions, such as nucleophilic additions. The compound's molecular structure suggests it may exhibit biological activity, making it of interest in medicinal chemistry and drug development. Its solubility in organic solvents and potential for forming hydrogen bonds can influence its interactions in biological systems. As with many pyrrole derivatives, it may also display interesting electronic properties due to the conjugated system within the ring. Safety and handling precautions should be observed, as with all chemical substances, particularly those with potential biological activity.

Formula: C₁₀H₁₃NO₃

InChI: InChI=1S/C10H13NO3/c1-4-9(12)7-5-8(10(13)14-3)11(2)6-7/h5-6H,4H2,1-3H3

InChI key: InChIKey=XFRSMPAXGYJFGB-UHFFFAOYSA-N

SMILES: C(OC)(=O)C1=CC(C(CC)=O)=CN1C

Synonyms:

• Methyl 1-methyl-4-(1-oxopropyl)-1H-pyrrole-2-carboxylate
• 1H-Pyrrole-2-carboxylic acid, 1-methyl-4-(1-oxopropyl)-, methyl ester