4-(((5-Bromothiophen-2-yl)methylene)amino)-3-(3-chlorophenyl)-1H-1,2,4-triazole-5(4H)-thione CAS 478255-45-7

Purity 97%+In StockPharmaceutical Standards
CAS No.478255-45-7
Molecular FormulaC13H8BrClN4S2
Molecular Weight399.72 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-(((5-Bromothiophen-2-yl)methylene)amino)-3-(3-chlorophenyl)-1H-1,2,4-triazole-5(4H)-thione CAS 478255-45-7 chemical structure

Description

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.

CATO supplies 4-(((5-Bromothiophen-2-yl)methylene)amino)-3-(3-chlorophenyl)-1H-1,2,4-triazole-5(4H)-thione (CAS 478255-45-7), a certified reference material (molecular formula C13H8BrClN4S2, MW 399.72 g/mol) for analytical method development and quality control.

Owing to a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, chlorine/bromine substitution, 4-(((5-Bromothiophen-2-yl)methylene)amino)-3-(3-chlorophenyl)-1H-1,2,4-triazole-5(4H)-thione is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 399.72 g/mol — guide the selection of appropriate sample preparation and analytical techniques. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

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.

Physical & Chemical Properties

Molecular FormulaC13H8BrClN4S2
Molecular Weight399.72 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)11.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentCl/Br-containing
Nitrogen Atoms4
Sulfur Atoms2

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