CAS 773139-06-3

Ethyl 2-chloro-6-methylbenzoate

Description:

Ethyl 2-chloro-6-methylbenzoate is an organic compound classified as an aromatic ester. It features a benzoate structure with an ethyl group attached to the oxygen of the ester functional group, and a chlorine atom and a methyl group positioned on the aromatic ring. This compound is typically a colorless to pale yellow liquid with a characteristic odor. It is soluble in organic solvents but has limited solubility in water due to its hydrophobic aromatic structure. Ethyl 2-chloro-6-methylbenzoate is often used in organic synthesis and may serve as an intermediate in the production of various pharmaceuticals and agrochemicals. Its reactivity is influenced by the presence of the chlorine substituent, which can participate in nucleophilic substitution reactions. Safety data indicates that, like many chlorinated compounds, it should be handled with care due to potential health hazards, including skin and respiratory irritation. Proper storage and handling protocols are essential to mitigate risks associated with exposure.

Formula: C₁₀H₁₁ClO₂

InChI: InChI=1S/C10H11ClO2/c1-3-13-10(12)9-7(2)5-4-6-8(9)11/h4-6H,3H2,1-2H3

InChI key: InChIKey=DUKSBWBJTZVOPF-UHFFFAOYSA-N

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

Synonyms:

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