2,2-difluoro-2-(1-methyl-1H-1,3-benzodiazol-2-yl)acetic acid CAS 80944-03-2

Purity 97%+In StockPharmaceutical Standards
CAS No.80944-03-2
Molecular FormulaC10H16F2N2O2
Molecular Weight234.24 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2,2-difluoro-2-(1-methyl-1H-1,3-benzodiazol-2-yl)acetic acid CAS 80944-03-2 chemical structure

Description

Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 2,2-difluoro-2-(1-methyl-1H-1,3-benzodiazol-2-yl)acetic acid.

2,2-difluoro-2-(1-methyl-1H-1,3-benzodiazol-2-yl)acetic acid (CAS 80944-03-2), molecular formula C10H16F2N2O2 and molecular weight 234.24 g/mol, is a CATO reference standard with documented purity and traceability.

Based on its molecular formula C10H16F2N2O2, 2,2-difluoro-2-(1-methyl-1H-1,3-benzodiazol-2-yl)acetic acid contains an amide group, a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 234.24 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

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 FormulaC10H16F2N2O2
Molecular Weight234.24 g/mol
AppearanceWhite to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry, keep tightly closed to prevent evaporation
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; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)3.0
UV AbsorptionUV-absorbing
CAS Registry Year (est.)1980
Halogen ContentF-containing
Nitrogen Atoms2

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