3-Chloro-4-fluoro-5-propoxyphenylboronic acid CAS 2096331-01-8

Purity 97%+In StockPharmaceutical Standards
CAS No.2096331-01-8
Molecular FormulaC9H11BClFO3
Molecular Weight232.44 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-Chloro-4-fluoro-5-propoxyphenylboronic acid CAS 2096331-01-8 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 3-Chloro-4-fluoro-5-propoxyphenylboronic acid.

3-Chloro-4-fluoro-5-propoxyphenylboronic acid (CAS 2096331-01-8) is a high-purity analytical reference standard with the molecular formula C9H11BClFO3 and a molecular weight of 232.44 g/mol.

3-Chloro-4-fluoro-5-propoxyphenylboronic acid (C9H11BClFO3) contains a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution. It is notably hygroscopic, halogen substitution raises its density and boiling point, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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 FormulaC9H11BClFO3
Molecular Weight232.44 g/mol
Purity97%+
StorageStore in a cool place (≤25°C), keep sealed and dry, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, ethanol, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)3.5
UV AbsorptionUV-absorbing
CAS Registry Year (est.)1997
Halogen ContentF/Cl-containing

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