3-Methylisothiazolo[5,4-d]pyrimidin-4(5h)-one CAS 58648-95-6

Purity 97%+In StockPharmaceutical Standards
CAS No.58648-95-6
Molecular FormulaC6H5N3OS
Molecular Weight167.19 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-Methylisothiazolo[5,4-d]pyrimidin-4(5h)-one CAS 58648-95-6 chemical structure

Description

CATO manufactures 3-Methylisothiazolo[5,4-d]pyrimidin-4(5h)-one 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.

CATO supplies 3-Methylisothiazolo[5,4-d]pyrimidin-4(5h)-one (CAS 58648-95-6), a certified reference material (molecular formula C6H5N3OS, MW 167.19 g/mol) for analytical method development and quality control.

Owing to an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, an aromatic ring system, 3-Methylisothiazolo[5,4-d]pyrimidin-4(5h)-one is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 167.19 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.

Physical & Chemical Properties

Molecular FormulaC6H5N3OS
Molecular Weight167.19 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
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1973
Nitrogen Atoms3
Sulfur Atoms1

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