4-Nitroisothiazole CAS 931-07-7

Purity 97%+In StockPharmaceutical Standards
CAS No.931-07-7
Molecular FormulaC3H2N2O2S
Molecular Weight130.13 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-Nitroisothiazole CAS 931-07-7 chemical structure

Description

Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 4-Nitroisothiazole.

4-Nitroisothiazole (CAS 931-07-7) is a high-purity analytical reference standard with the molecular formula C3H2N2O2S and a molecular weight of 130.13 g/mol.

Owing to an amide group, a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, 4-Nitroisothiazole is typically off-white to pale yellow liquid. Its solid-state physicochemical attributes — including a molecular weight of 130.13 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.

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

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 FormulaC3H2N2O2S
Molecular Weight130.13 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)4.0
UV AbsorptionUV-absorbing
CAS Registry Year (est.)1957
Nitrogen Atoms2
Sulfur Atoms1

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