CAS 1171923-83-3

Methyl 2-[[[5-(1,1-dimethylethyl)-2-methylphenyl]methoxy]methyl]-6-methoxybenzoate

Description:

Methyl 2-[[[5-(1,1-dimethylethyl)-2-methylphenyl]methoxy]methyl]-6-methoxybenzoate, identified by its CAS number 1171923-83-3, is an organic compound characterized by its complex structure, which includes multiple functional groups such as methoxy and ester functionalities. This compound features a benzoate moiety, indicating it is an ester derived from benzoic acid, and it contains a bulky tert-butyl group, which can influence its physical properties and reactivity. The presence of methoxy groups suggests potential for solubility in organic solvents and may also affect its electronic properties. The compound's structure implies potential applications in fields such as pharmaceuticals or agrochemicals, where such derivatives can exhibit biological activity or serve as intermediates in synthesis. Additionally, the steric hindrance introduced by the tert-butyl group may impact its interaction with biological targets or its stability under various conditions. Overall, this compound exemplifies the diversity of organic chemistry and the significance of structural features in determining chemical behavior and applications.

Formula: C₂₂H₂₈O₄

InChI: InChI=1S/C22H28O4/c1-15-10-11-18(22(2,3)4)12-17(15)14-26-13-16-8-7-9-19(24-5)20(16)21(23)25-6/h7-12H,13-14H2,1-6H3

InChI key: InChIKey=LHMVQKIGDGXPRU-UHFFFAOYSA-N

SMILES: C(OC)(=O)C1=C(COCC2=CC(C(C)(C)C)=CC=C2C)C=CC=C1OC

Synonyms:

• Benzoic acid, 2-[[[5-(1,1-dimethylethyl)-2-methylphenyl]methoxy]methyl]-6-methoxy-, methyl ester
• Methyl 2-[[[5-(1,1-dimethylethyl)-2-methylphenyl]methoxy]methyl]-6-methoxybenzoate