3-(3,4-Dimethoxyphenyl)-2-methylpropanoic acid CAS 53979-33-2

Purity 97%+In StockPharmaceutical Standards
CAS No.53979-33-2
Molecular FormulaC12H16O4
Molecular Weight224.25 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(3,4-Dimethoxyphenyl)-2-methylpropanoic acid CAS 53979-33-2 chemical structure

Description

The occurrence of 3-(3,4-Dimethoxyphenyl)-2-methylpropanoic acid is closely related to a carboxylic acid group, a hydroxyl group, an ether linkage, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

3-(3,4-Dimethoxyphenyl)-2-methylpropanoic acid (CAS 53979-33-2), molecular formula C12H16O4 and molecular weight 224.25 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C12H16O4, 3-(3,4-Dimethoxyphenyl)-2-methylpropanoic acid contains a carboxylic acid group, a hydroxyl group, an ether linkage, an aromatic ring system; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 224.25 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC12H16O4
Molecular Weight224.25 g/mol
AppearanceOff-white to pale yellow crystalline powder
Purity97%+
StorageStore in a cool place (≤25°C), keep sealed and dry
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1972

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