CAS 935765-04-1

Ethyl (αS)-α-(2-methylpropyl)-1H-pyrrole-1-acetate

Description:

Ethyl (αS)-α-(2-methylpropyl)-1H-pyrrole-1-acetate is a chemical compound characterized by its pyrrole ring structure, which is a five-membered aromatic heterocycle containing nitrogen. This compound features an ethyl acetate functional group, contributing to its ester characteristics. The presence of the 2-methylpropyl substituent on the pyrrole ring influences its physical and chemical properties, such as solubility and reactivity. Typically, compounds like this may exhibit biological activity, making them of interest in pharmaceutical and agrochemical research. The stereochemistry indicated by the (αS) designation suggests a specific spatial arrangement of atoms, which can significantly affect the compound's interaction with biological systems. In terms of safety and handling, as with many organic compounds, it is essential to consult safety data sheets for information on toxicity, flammability, and proper storage conditions. Overall, this compound exemplifies the complexity and diversity of organic chemistry, particularly in the realm of nitrogen-containing heterocycles.

Formula: C₁₂H₁₉NO₂

InChI: InChI=1S/C12H19NO2/c1-4-15-12(14)11(9-10(2)3)13-7-5-6-8-13/h5-8,10-11H,4,9H2,1-3H3/t11-/m0/s1

InChI key: InChIKey=ZQQLFDUELNLZPT-NSHDSACASA-N

SMILES: [C@@H](C(OCC)=O)(CC(C)C)N1C=CC=C1

Synonyms:

• Ethyl (αS)-α-(2-methylpropyl)-1H-pyrrole-1-acetate
• 1H-Pyrrole-1-acetic acid, α-(2-methylpropyl)-, ethyl ester, (αS)-