CAS 959961-64-9

Methyl (2E)-3-(3-bromo-4-fluorophenyl)-2-propenoate

Description:

Methyl (2E)-3-(3-bromo-4-fluorophenyl)-2-propenoate, with the CAS number 959961-64-9, is an organic compound characterized by its ester functional group and a conjugated double bond system. This compound features a methyl ester derived from a propenoic acid, specifically possessing a trans configuration at the double bond (2E). The presence of a 3-bromo-4-fluorophenyl group indicates that it has both bromine and fluorine substituents on the aromatic ring, which can influence its reactivity and physical properties. The bromine atom typically enhances the compound's electrophilicity, while the fluorine atom can affect its polarity and solubility. Methyl (2E)-3-(3-bromo-4-fluorophenyl)-2-propenoate may exhibit interesting biological activities and could be of interest in medicinal chemistry and material science. Its synthesis and reactivity can be explored in various organic reactions, including nucleophilic substitutions and polymerization processes. Overall, this compound represents a valuable structure for further research and application in diverse chemical fields.

Formula: C₁₀H₈BrFO₂

InChI: InChI=1S/C10H8BrFO2/c1-14-10(13)5-3-7-2-4-9(12)8(11)6-7/h2-6H,1H3/b5-3+

InChI key: InChIKey=CRHGUYSSCRYBIO-HWKANZROSA-N

SMILES: C(=C/C(OC)=O)\C1=CC(Br)=C(F)C=C1

Synonyms:

• 2-Propenoic acid, 3-(3-bromo-4-fluorophenyl)-, methyl ester, (2E)-
• Methyl (2E)-3-(3-bromo-4-fluorophenyl)-2-propenoate