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CAS 898764-97-1

:

Ethyl 4-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]-η-oxobenzeneoctanoate

Description:
Ethyl 4-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]-η-oxobenzeneoctanoate, identified by its CAS number 898764-97-1, is a chemical compound that features a complex structure combining an ethyl ester with a pyrrole moiety. This compound typically exhibits characteristics associated with both esters and nitrogen-containing heterocycles. The presence of the ethyl group suggests it may have moderate volatility and solubility in organic solvents, while the pyrrole ring can contribute to its reactivity and potential biological activity. The oxobenzene component indicates the presence of a carbonyl group adjacent to an aromatic system, which may enhance its stability and influence its electronic properties. Such compounds often find applications in pharmaceuticals, agrochemicals, or as intermediates in organic synthesis due to their diverse functional groups. However, specific physical properties such as melting point, boiling point, and solubility would require empirical data for precise characterization. Overall, this compound exemplifies the complexity and versatility found in organic chemistry.
Formula:C21H29NO3
InChI:InChI=1S/C21H29NO3/c1-2-25-21(24)10-6-4-3-5-9-20(23)19-13-11-18(12-14-19)17-22-15-7-8-16-22/h7-8,11-14H,2-6,9-10,15-17H2,1H3
InChI key:InChIKey=VWARPRJBEROZQV-UHFFFAOYSA-N
SMILES:C(CCCCCCC(OCC)=O)(=O)C1=CC=C(CN2CC=CC2)C=C1
Synonyms:
  • Benzeneoctanoic acid, 4-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]-η-oxo-, ethyl ester
  • Ethyl 4-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]-η-oxobenzeneoctanoate
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