5-{[(2-Chlorobenzyl)thio]methyl}-4-phenyl-4H-1,2,4-triazole-3-thiol CAS 446052-36-4

Purity 97%+In StockPharmaceutical Standards
CAS No.446052-36-4
Molecular FormulaC16H14ClN3S2
Molecular Weight347.89 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-{[(2-Chlorobenzyl)thio]methyl}-4-phenyl-4H-1,2,4-triazole-3-thiol CAS 446052-36-4 chemical structure

Description

Based on its molecular formula C16H14ClN3S2, 5-{[(2-Chlorobenzyl)thio]methyl}-4-phenyl-4H-1,2,4-triazole-3-thiol contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 347.89 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

5-{[(2-Chlorobenzyl)thio]methyl}-4-phenyl-4H-1,2,4-triazole-3-thiol (CAS 446052-36-4) is a high-purity analytical reference standard with the molecular formula C16H14ClN3S2 and a molecular weight of 347.89 g/mol.

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

CATO manufactures 5-{[(2-Chlorobenzyl)thio]methyl}-4-phenyl-4H-1,2,4-triazole-3-thiol under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

Physical & Chemical Properties

Molecular FormulaC16H14ClN3S2
Molecular Weight347.89 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-containing
Nitrogen Atoms3
Sulfur Atoms2

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