5-Bromobenzo[1,3]dioxole-4-boronic acid pinacol ester CAS 2121514-16-5

Purity 97%+In StockPharmaceutical Standards
CAS No.2121514-16-5
Molecular FormulaC13H16BBrO4
Molecular Weight326.98 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-Bromobenzo[1,3]dioxole-4-boronic acid pinacol ester CAS 2121514-16-5 chemical structure

Description

The occurrence of 5-Bromobenzo[1,3]dioxole-4-boronic acid pinacol ester is closely related to a carboxylic acid group, a hydroxyl group, an ether linkage, bromine substitution, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

5-Bromobenzo[1,3]dioxole-4-boronic acid pinacol ester (CAS 2121514-16-5), molecular formula C13H16BBrO4 and molecular weight 326.98 g/mol, is a CATO reference standard with documented purity and traceability.

Owing to a carboxylic acid group, a hydroxyl group, an ether linkage, bromine substitution, an aromatic ring system, 5-Bromobenzo[1,3]dioxole-4-boronic acid pinacol ester is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 326.98 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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.

CATO manufactures 5-Bromobenzo[1,3]dioxole-4-boronic acid pinacol ester under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

Physical & Chemical Properties

Molecular FormulaC13H16BBrO4
Molecular Weight326.98 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor)
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; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)5.5
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1997
Halogen ContentBr-containing

Related Bromobenzo Standards

Recommended Standards

Why CATO?