5-isocyano-2H-1,3-benzodioxole CAS 165459-70-1

Description

Compared with other compounds in its class, the molecular weight of 147.13 g/mol gives 5-isocyano-2H-1,3-benzodioxole distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

5-isocyano-2H-1,3-benzodioxole (CAS 165459-70-1), molecular formula C8H5NO2 and molecular weight 147.13 g/mol, is a CATO reference standard with documented purity and traceability.

5-isocyano-2H-1,3-benzodioxole (C8H5NO2) contains an amino-acid-derived structure, an amide group, a hydroxyl group, an ether linkage. The carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. 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

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