4-[4-(4-Methoxybenzenesulfonyl)piperazin-1-yl]benzonitrile CAS 478046-93-4

Purity 97%+In StockPharmaceutical Standards
CAS No.478046-93-4
Molecular FormulaC18H19N3O3S
Molecular Weight357.43 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-[4-(4-Methoxybenzenesulfonyl)piperazin-1-yl]benzonitrile CAS 478046-93-4 chemical structure

Description

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

4-[4-(4-Methoxybenzenesulfonyl)piperazin-1-yl]benzonitrile (CAS 478046-93-4), molecular formula C18H19N3O3S and molecular weight 357.43 g/mol, is a CATO reference standard with documented purity and traceability.

Owing to a steroid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, 4-[4-(4-Methoxybenzenesulfonyl)piperazin-1-yl]benzonitrile is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 357.43 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.

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 FormulaC18H19N3O3S
Molecular Weight357.43 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.)2025
Nitrogen Atoms3
Sulfur Atoms1

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