CAS 898792-69-3
:Ethyl 3-bromo-δ-oxobenzenepentanoate
Description:
Ethyl 3-bromo-δ-oxobenzenepentanoate, identified by its CAS number 898792-69-3, is an organic compound characterized by its ester functional group, which is typical of many compounds in organic chemistry. This substance features a bromine atom attached to a benzene ring, indicating its potential for reactivity and participation in various chemical reactions, such as nucleophilic substitution. The presence of the δ-oxobenzenepentanoate structure suggests that it contains a carbonyl group (C=O) adjacent to the benzene ring, contributing to its reactivity and potential applications in synthesis. The ethyl group indicates that it is an ester, which often results in pleasant aromas and flavors, making it of interest in the fragrance and flavor industries. Additionally, the compound's molecular structure may impart specific physical properties, such as solubility in organic solvents and varying boiling and melting points. Overall, this compound's unique structure positions it as a valuable intermediate in organic synthesis and potentially in pharmaceutical applications.
Formula:C13H15BrO3
InChI:InChI=1S/C13H15BrO3/c1-2-17-13(16)8-4-7-12(15)10-5-3-6-11(14)9-10/h3,5-6,9H,2,4,7-8H2,1H3
InChI key:InChIKey=FLIAHYCARFMIMB-UHFFFAOYSA-N
SMILES:C(CCCC(OCC)=O)(=O)C1=CC(Br)=CC=C1
Synonyms:- Benzenepentanoic acid, 3-bromo-δ-oxo-, ethyl ester
- Ethyl 3-bromo-δ-oxobenzenepentanoate
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