5-Methyl-3-((4-methylbenzyl)sulfonyl)isothiazole-4-carbonitrile CAS 343375-70-2

Description

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.

5-Methyl-3-((4-methylbenzyl)sulfonyl)isothiazole-4-carbonitrile (CAS 343375-70-2), molecular formula C13H12N2O2S2 and molecular weight 292.38 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 5-Methyl-3-((4-methylbenzyl)sulfonyl)isothiazole-4-carbonitrile (C13H12N2O2S2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 9.0, corresponding to approximately 9 ring(s) or double-bond equivalent(s). With a molecular weight of 292.38 g/mol, it falls into the medium-molecular-weight range. 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

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