5-(3,4-Dimethoxyphenyl)-1h-pyrazole-4-carboxylic acid CAS 879996-77-7

Purity 97%+In StockPharmaceutical Standards
CAS No.879996-77-7
Molecular FormulaC12H12N2O4
Molecular Weight248.23 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-(3,4-Dimethoxyphenyl)-1h-pyrazole-4-carboxylic acid CAS 879996-77-7 chemical structure

Description

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.

5-(3,4-Dimethoxyphenyl)-1h-pyrazole-4-carboxylic acid (CAS 879996-77-7), molecular formula C12H12N2O4 and molecular weight 248.23 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 5-(3,4-Dimethoxyphenyl)-1h-pyrazole-4-carboxylic acid (C12H12N2O4) contains an amino-acid-derived structure, an amide group, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 8.0, corresponding to approximately 8 ring(s) or double-bond equivalent(s). With a molecular weight of 248.23 g/mol, it falls into the medium-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

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 FormulaC12H12N2O4
Molecular Weight248.23 g/mol
AppearancePale yellow to yellow crystalline powder
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)8.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1987
Nitrogen Atoms2

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