CAS 832739-81-8

Methyl 3-[(2,6-dichlorophenoxy)methyl]benzoate

Description:

Methyl 3-[(2,6-dichlorophenoxy)methyl]benzoate, with the CAS number 832739-81-8, is an organic compound characterized by its ester functional group, which is derived from benzoic acid and methanol. This compound features a methyl ester group attached to a benzoate structure, along with a 2,6-dichlorophenoxy group that contributes to its unique properties. The presence of chlorine atoms in the aromatic ring enhances its lipophilicity and may influence its biological activity. Methyl 3-[(2,6-dichlorophenoxy)methyl]benzoate is typically a white to off-white solid at room temperature and is soluble in organic solvents. It may exhibit various applications in fields such as agrochemicals, pharmaceuticals, or as an intermediate in organic synthesis. The compound's specific reactivity and stability can be influenced by the substituents on the aromatic rings, making it of interest for further research in medicinal chemistry and material science. Safety data should be consulted for handling and usage, as with any chemical substance.

Formula: C₁₅H₁₂Cl₂O₃

InChI: InChI=1S/C15H12Cl2O3/c1-19-15(18)11-5-2-4-10(8-11)9-20-14-12(16)6-3-7-13(14)17/h2-8H,9H2,1H3

InChI key: InChIKey=PVNIJRGFOWNTAW-UHFFFAOYSA-N

SMILES: O(CC1=CC(C(OC)=O)=CC=C1)C2=C(Cl)C=CC=C2Cl

Synonyms:

• Methyl 3-[(2,6-dichlorophenoxy)methyl]benzoate
• Benzoic acid, 3-[(2,6-dichlorophenoxy)methyl]-, methyl ester