5-Mercapto-[1,2,4]triazolo[4,3-a]pyrimidin-7(1H)-one CAS 161715-52-2

Purity 97%+In StockPharmaceutical Standards
CAS No.161715-52-2
Molecular FormulaC5H4N4OS
Molecular Weight168.18 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-Mercapto-[1,2,4]triazolo[4,3-a]pyrimidin-7(1H)-one CAS 161715-52-2 chemical structure

Description

5-Mercapto-[1,2,4]triazolo[4,3-a]pyrimidin-7(1H)-one (CAS 161715-52-2) is a high-purity analytical reference standard with the molecular formula C5H4N4OS and a molecular weight of 168.18 g/mol.

Based on its molecular formula C5H4N4OS, 5-Mercapto-[1,2,4]triazolo[4,3-a]pyrimidin-7(1H)-one contains an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 168.18 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

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 FormulaC5H4N4OS
Molecular Weight168.18 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
CAS Registry Year (est.)2003
Nitrogen Atoms4
Sulfur Atoms1

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