CAS 438221-72-8

Methyl 3-[(3,5-dimethylphenoxy)methyl]benzoate

Description:

Methyl 3-[(3,5-dimethylphenoxy)methyl]benzoate, with the CAS number 438221-72-8, 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 phenoxy group that contains two methyl substituents on the aromatic ring. The presence of these substituents can influence the compound's solubility, reactivity, and overall chemical behavior. Typically, compounds like this may exhibit moderate to high lipophilicity due to the aromatic components, which can affect their interaction with biological systems. Methyl 3-[(3,5-dimethylphenoxy)methyl]benzoate may be of interest in various applications, including pharmaceuticals, agrochemicals, or as intermediates in organic synthesis. Its specific properties, such as melting point, boiling point, and solubility, would need to be determined experimentally or sourced from reliable chemical databases for precise applications.

Formula: C₁₇H₁₈O₃

InChI: InChI=1S/C17H18O3/c1-12-7-13(2)9-16(8-12)20-11-14-5-4-6-15(10-14)17(18)19-3/h4-10H,11H2,1-3H3

InChI key: InChIKey=WPZDIBRPBIXICZ-UHFFFAOYSA-N

SMILES: C(OC1=CC(C)=CC(C)=C1)C2=CC(C(OC)=O)=CC=C2

Synonyms:

• Benzoic acid, 3-[(3,5-dimethylphenoxy)methyl]-, methyl ester
• Methyl 3-[(3,5-dimethylphenoxy)methyl]benzoate