4-((4-Methoxybenzyl)thio)-7-nitrobenzo[c][1,2,5]oxadiazole CAS 882289-31-8

Purity 97%+In StockPharmaceutical Standards
CAS No.882289-31-8
Molecular FormulaC14H11N3O4S
Molecular Weight317.32 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-((4-Methoxybenzyl)thio)-7-nitrobenzo[c][1,2,5]oxadiazole CAS 882289-31-8 chemical structure

Description

Structurally, 4-((4-Methoxybenzyl)thio)-7-nitrobenzo[c][1,2,5]oxadiazole (C14H11N3O4S) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 11.0, corresponding to approximately 11 ring(s) or double-bond equivalent(s). With a molecular weight of 317.32 g/mol, it falls into the moderately-high-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

4-((4-Methoxybenzyl)thio)-7-nitrobenzo[c][1,2,5]oxadiazole (CAS 882289-31-8) is a high-purity analytical reference standard with the molecular formula C14H11N3O4S and a molecular weight of 317.32 g/mol.

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 FormulaC14H11N3O4S
Molecular Weight317.32 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.)1987
Nitrogen Atoms3
Sulfur Atoms1

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