3-Bromo-5-(methylsulfonyl)-4H-1,2,4-triazole hydrochloride CAS 2361643-87-8

Purity 97%+In StockPharmaceutical Standards
CAS No.2361643-87-8
Molecular FormulaC3H4BrN3O2S
Molecular WeightN/A
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-Bromo-5-(methylsulfonyl)-4H-1,2,4-triazole hydrochloride CAS 2361643-87-8 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 262.51 g/mol gives 3-Bromo-5-(methylsulfonyl)-4H-1,2,4-triazole hydrochloride distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

3-Bromo-5-(methylsulfonyl)-4H-1,2,4-triazole hydrochloride (CAS 2361643-87-8) is a high-purity analytical reference standard with the molecular formula C3H4BrN3O2SHCl and a molecular weight of 262.51 g/mol.

3-Bromo-5-(methylsulfonyl)-4H-1,2,4-triazole hydrochloride (C3H4BrN3O2SHCl) contains an amide group, a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, chlorine/bromine 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 FormulaC3H4BrN3O2S HCl
Molecular Weight262.51 g/mol
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
StabilityLight-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)2.0
CAS Registry Year (est.)1999
Halogen ContentCl/Br-containing
Nitrogen Atoms3
Sulfur Atoms1

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