Pyrimidin-5-ylboronic acid hemihydrate CAS 696602-91-2

Purity 97%+In StockPharmaceutical Standards
CAS No.696602-91-2
Molecular Formula2*C4H5BN2O2
Molecular WeightN/A
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Pyrimidin-5-ylboronic acid hemihydrate CAS 696602-91-2 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 141.92 g/mol gives Pyrimidin-5-ylboronic acid hemihydrate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

Pyrimidin-5-ylboronic acid hemihydrate (CAS 696602-91-2), molecular formula C4H5BN2O2H2O and molecular weight 141.92 g/mol, is a CATO reference standard with documented purity and traceability.

Owing to an amino-acid-derived structure, an amide group, a hydroxyl group, an ether linkage, Pyrimidin-5-ylboronic acid hemihydrate is typically white to off-white liquid. Its solid-state physicochemical attributes — including a molecular weight of 141.92 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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 Formula2*C4H5BN2O2 H2O
Molecular Weight141.92 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in methanol, ethanol, DMSO, water
StabilityLight-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)2.5
CAS Registry Year (est.)1985
Nitrogen Atoms2

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Why CATO?