CAS 773135-51-6

Ethyl 6-chloro-2-fluoro-3-methylbenzoate

Description:

Ethyl 6-chloro-2-fluoro-3-methylbenzoate is an organic compound characterized by its aromatic structure, which includes a benzoate moiety. This compound features a chloro and a fluoro substituent on the benzene ring, specifically at the 6th and 2nd positions, respectively, along with a methyl group at the 3rd position. The presence of these halogen substituents can influence the compound's reactivity and polarity, making it of interest in various chemical applications, including medicinal chemistry and materials science. Ethyl 6-chloro-2-fluoro-3-methylbenzoate is typically a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is soluble in organic solvents, which is common for benzoate esters, while its solubility in water is limited due to the hydrophobic nature of the aromatic ring. The compound may exhibit biological activity, making it a candidate for further research in pharmacology. Safety precautions should be taken when handling this substance, as it may pose health risks typical of halogenated organic compounds.

Formula: C₁₀H₁₀ClFO₂

InChI: InChI=1S/C10H10ClFO2/c1-3-14-10(13)8-7(11)5-4-6(2)9(8)12/h4-5H,3H2,1-2H3

InChI key: InChIKey=ARPDQWYLGJXNMC-UHFFFAOYSA-N

SMILES: C(OCC)(=O)C1=C(F)C(C)=CC=C1Cl

Synonyms:

• Ethyl 6-chloro-2-fluoro-3-methylbenzoate
• Benzoic acid, 6-chloro-2-fluoro-3-methyl-, ethyl ester