Description

Ethyl 2-(3,5-dimethoxyphenyl)acetate (CAS No. 65976-77-4) is a high-purity organic ester compound with the molecular formula C₁₂H₁₆O₄. This specialized chemical features a phenylacetate backbone substituted with methoxy groups at the 3 and 5 positions, making it a valuable intermediate for pharmaceutical synthesis and fine chemical applications. The product is supplied as a clear to pale yellow liquid with ≥95% purity (GC), suitable for research and industrial use. With excellent solubility in common organic solvents (ethanol, DMSO, acetone) and stability under standard storage conditions, this ester is ideal for nucleophilic substitution reactions, ester hydrolysis studies, and as a building block for bioactive molecules. Each batch undergoes rigorous QC testing including GC-MS, HPLC, and ¹H NMR analysis to ensure consistency. Available in research (5g, 25g) and bulk (1kg+) quantities with optional custom purification.

Properties

• CAS Number: 65976-77-4
• Complexity: 205
• IUPAC Name: ethyl 2-(3,5-dimethoxyphenyl)acetate
• InChI: InChI=1S/C12H16O4/c1-4-16-12(13)7-9-5-10(14-2)8-11(6-9)15-3/h5-6,8H,4,7H2,1-3H3
• InChI Key: LPMABDMACJOZAT-UHFFFAOYSA-N
• Exact Mass: 224.10485899
• Molecular Formula: C12H16O4
• Molecular Weight: 224.25
• SMILES: CCOC(=O)CC1=CC(=CC(=C1)OC)OC
• Topological: 44.8
• Monoisotopic Mass: 224.10485899
• Synonyms: Ethyl 2-(3,5-dimethoxyphenyl)acetate, 65976-77-4, ethyl 3,5-dimethoxyphenylacetate, MFCD11111879, (3,5-Dimethoxyphenyl)acetic acid ethyl ester, (3,5-dimethoxy-phenyl)-acetic acid ethyl ester, SCHEMBL1872932, DTXSID60474127, LPMABDMACJOZAT-UHFFFAOYSA-N, AKOS016010238, CS-W022642, DS-5767, DA-41762, SY043382, (3,5-dimethoxyphenyl)-acetic acid ethyl ester, Ethyl 2-(3 pound not5-dimethoxyphenyl)acetate

This compound serves as a key synthetic intermediate for pharmaceutical research, particularly in the development of CNS-active compounds and anti-inflammatory agents. The dimethoxyphenyl moiety makes it valuable for structure-activity relationship studies in medicinal chemistry. Researchers utilize it in palladium-catalyzed coupling reactions and as a precursor for heterocyclic systems. In material science, it finds application in liquid crystal and polymer additive synthesis.

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