CAS 898762-97-5
:Ethyl 2-[2-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]benzoyl]benzoate
Description:
Ethyl 2-[2-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]benzoyl]benzoate, with the CAS number 898762-97-5, is a synthetic organic compound characterized by its complex structure, which includes an ethyl ester functional group and a pyrrole moiety. This compound typically exhibits properties such as moderate solubility in organic solvents and limited solubility in water, which is common for many esters and aromatic compounds. Its molecular structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals due to the presence of the pyrrole ring, known for its biological activity. The compound may also display interesting photophysical properties, making it a candidate for studies in materials science or organic electronics. Additionally, its synthesis involves multi-step reactions, often requiring careful control of reaction conditions to achieve the desired purity and yield. As with many chemical substances, safety data sheets should be consulted for handling and toxicity information, as the specific biological effects and environmental impact would depend on its concentration and exposure.
Formula:C21H21NO3
InChI:InChI=1/C21H21NO3/c1-2-25-21(24)19-12-6-5-11-18(19)20(23)17-10-4-3-9-16(17)15-22-13-7-8-14-22/h3-12H,2,13-15H2,1H3
InChI key:InChIKey=KNFXGQMTGDLHBJ-UHFFFAOYSA-N
SMILES:C(=O)(C1=C(C(OCC)=O)C=CC=C1)C2=C(CN3CC=CC3)C=CC=C2
Synonyms:- Ethyl 2-[2-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]benzoyl]benzoate
- Benzoic acid, 2-[2-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]benzoyl]-, ethyl ester
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