3-(((2,6-Dichlorobenzyl)thio)methyl)-4-ethyl-5-((4-nitrobenzyl)thio)-4H-1,2,4-triazole CAS 344270-95-7

Purity 97%+In StockPharmaceutical Standards
CAS No.344270-95-7
Molecular FormulaC19H18Cl2N4O2S2
Molecular Weight469.41 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-(((2,6-Dichlorobenzyl)thio)methyl)-4-ethyl-5-((4-nitrobenzyl)thio)-4H-1,2,4-triazole CAS 344270-95-7 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 469.41 g/mol gives 3-(((2,6-Dichlorobenzyl)thio)methyl)-4-ethyl-5-((4-nitrobenzyl)thio)-4H-1,2,4-triazole distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

3-(((2,6-Dichlorobenzyl)thio)methyl)-4-ethyl-5-((4-nitrobenzyl)thio)-4H-1,2,4-triazole (CAS 344270-95-7), molecular formula C19H18Cl2N4O2S2 and molecular weight 469.41 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, chlorine substitution, 3-(((2,6-Dichlorobenzyl)thio)methyl)-4-ethyl-5-((4-nitrobenzyl)thio)-4H-1,2,4-triazole is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 469.41 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 FormulaC19H18Cl2N4O2S2
Molecular Weight469.41 g/mol
Purity97%+
StorageStore in a cool place (≤25°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; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)12.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentCl-containing
Nitrogen Atoms4
Sulfur Atoms2

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