3-Chloro-2-nitrobenzenesulfonyl chloride CAS 78846-40-9

Purity 97%+In StockPharmaceutical Standards
CAS No.78846-40-9
Molecular FormulaC6H3Cl2NO4S
Molecular Weight256.06 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-Chloro-2-nitrobenzenesulfonyl chloride CAS 78846-40-9 chemical structure

Description

3-Chloro-2-nitrobenzenesulfonyl chloride (CAS 78846-40-9) is a high-purity analytical reference standard with the molecular formula C6H3Cl2NO4S and a molecular weight of 256.06 g/mol.

Structurally, 3-Chloro-2-nitrobenzenesulfonyl chloride (C6H3Cl2NO4S) contains an amide group, a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, chlorine substitution, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 5.0, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 256.06 g/mol, it falls into the medium-molecular-weight range. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

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 FormulaC6H3Cl2NO4S
Molecular Weight256.06 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, ethanol, DMSO, water
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1979
Halogen ContentCl-containing
Nitrogen Atoms1
Sulfur Atoms1

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