CAS 1160574-69-5

Ethyl 3,4-dibromo-5-fluorobenzoate

Description:

Ethyl 3,4-dibromo-5-fluorobenzoate is an organic compound characterized by its aromatic structure, which includes a benzoate moiety substituted with bromine and fluorine atoms. The presence of two bromine atoms at the 3 and 4 positions and a fluorine atom at the 5 position on the benzene ring contributes to its unique chemical properties, including increased reactivity and potential for various chemical transformations. The ethyl ester functional group enhances its solubility in organic solvents, making it useful in synthetic applications. This compound may exhibit biological activity, which could be of interest in pharmaceutical research, particularly in the development of new drugs or agrochemicals. Its molecular structure suggests potential for interactions with biological targets, and the halogen substituents may influence its lipophilicity and metabolic stability. As with many halogenated compounds, safety considerations regarding toxicity and environmental impact should be taken into account during handling and application.

Formula: C₉H₇Br₂FO₂

InChI: InChI=1S/C9H7Br2FO2/c1-2-14-9(13)5-3-6(10)8(11)7(12)4-5/h3-4H,2H2,1H3

InChI key: InChIKey=QQHFPRFYZUWPON-UHFFFAOYSA-N

SMILES: C(OCC)(=O)C1=CC(Br)=C(Br)C(F)=C1

Synonyms:

• Benzoic acid, 3,4-dibromo-5-fluoro-, ethyl ester
• Ethyl 3,4-dibromo-5-fluorobenzoate