4-(2,4-Dichlorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione CAS 668471-48-5

Purity 97%+In StockPharmaceutical Standards
CAS No.668471-48-5
Molecular FormulaC13H10Cl2N4S
Molecular Weight325.22 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-(2,4-Dichlorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione CAS 668471-48-5 chemical structure

Description

4-(2,4-Dichlorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 668471-48-5) is a high-purity analytical reference standard with the molecular formula C13H10Cl2N4S and a molecular weight of 325.22 g/mol.

4-(2,4-Dichlorophenyl)-5-(1-methyl-1H-pyrrol-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (C13H10Cl2N4S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, chlorine substitution. Halogen substitution raises its density and boiling point, its high carbon-to-hydrogen ratio confers good lipid solubility; 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.

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 FormulaC13H10Cl2N4S
Molecular Weight325.22 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)10.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1985
Halogen ContentCl-containing
Nitrogen Atoms4
Sulfur Atoms1

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