Sodium 2H-1,3-benzodioxole-5-sulfinate CAS 253594-68-2

Purity 97%+In StockPharmaceutical Standards
CAS No.253594-68-2
Molecular FormulaC7H5O4S
Molecular WeightN/A
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Sodium 2H-1,3-benzodioxole-5-sulfinate CAS 253594-68-2 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 208.16 g/mol gives Sodium 2H-1,3-benzodioxole-5-sulfinate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

Sodium 2H-1,3-benzodioxole-5-sulfinate (CAS 253594-68-2), molecular formula C7H5O4SNa and molecular weight 208.16 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, Sodium 2H-1,3-benzodioxole-5-sulfinate (C7H5O4SNa) contains a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 5.5, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 208.16 g/mol, it falls into the medium-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

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 FormulaC7H5O4S Na
Molecular Weight208.16 g/mol
Purity97%+
StorageStore in a cool place (≤25°C), keep sealed and dry
Solubility (reference)Soluble in methanol, ethanol, DMSO, water
StabilityMay oxidize slowly on prolonged air exposure; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)5.5
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Sulfur Atoms1

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