methyl 3-cyano-2-fluorobenzoate
$300.00
CAS No.: 1261453-50-2
Catalog No.: WLZ1805
Purity: 95%
MF: C9H6FNO2
MW: 179.15
Storage: 2-8 degree Celsius
SMILES: C(#N)C=1C(=C(C(=O)OC)C=CC1)F
Catalog No.: WLZ1805
Purity: 95%
MF: C9H6FNO2
MW: 179.15
Storage: 2-8 degree Celsius
SMILES: C(#N)C=1C(=C(C(=O)OC)C=CC1)F
CAS NO.: 1261453-50-2; methyl 3-cyano-2-fluorobenzoate. PROPERTIES: This fluorinated aromatic ester features a cyano group and a fluorine atom on a benzene ring connected to a methyl ester group, creating a molecule with potential applications in organic synthesis and pharmaceutical research. The methyl 3-cyano-2-fluorobenzoate typically appears as a white to off-white crystalline solid with moderate solubility in common organic solvents. Its molecular structure includes electron-withdrawing cyano and fluorine groups that influence the electronic properties of the aromatic system. For optimal stability and to prevent degradation, this compound should be stored at 2-8 degree Celsius in a tightly sealed container under anhydrous conditions. When handling, appropriate safety measures including nitrile gloves and safety goggles are essential. This compound is sensitive to moisture and may hydrolyze in aqueous environments. In case of accidental spillage, clean the area with a damp cloth and dispose of materials according to local regulations. APPLICATIONS: The methyl 3-cyano-2-fluorobenzoate serves as a valuable intermediate in the synthesis of highly functionalized aromatic compounds and materials with specific electronic properties. The ester group provides a handle for further functionalization through hydrolysis to the corresponding carboxylic acid or transesterification. In medicinal chemistry, this compound functions as a building block for developing pharmaceuticals targeting enzyme inhibitors and receptor modulators. The cyano and fluorine substituents contribute to target binding affinity and selectivity. Additionally, the molecule finds utility in materials science as a monomer for creating polymers with specific electronic and optical properties. Researchers utilizing this compound benefit from its defined substitution pattern, enabling the development of advanced materials with tailored electronic characteristics.
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