5-Nitro-2-(phenylthio)benzonitrile CAS 148331-73-1

Purity 97%+In StockPharmaceutical Standards
CAS No.148331-73-1
Molecular FormulaC13H8N2O2S
Molecular Weight256.28 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-Nitro-2-(phenylthio)benzonitrile CAS 148331-73-1 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 256.28 g/mol gives 5-Nitro-2-(phenylthio)benzonitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

5-Nitro-2-(phenylthio)benzonitrile (CAS 148331-73-1) is a high-purity analytical reference standard with the molecular formula C13H8N2O2S and a molecular weight of 256.28 g/mol.

5-Nitro-2-(phenylthio)benzonitrile (C13H8N2O2S) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage. It is notably hygroscopic, its high carbon-to-hydrogen ratio confers good lipid solubility, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. 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.

As a certified reference material (CRM), 5-Nitro-2-(phenylthio)benzonitrile meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.

Physical & Chemical Properties

Molecular FormulaC13H8N2O2S
Molecular Weight256.28 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)11.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1999
Nitrogen Atoms2
Sulfur Atoms1

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