5-(4-Chlorobenzyl)-4-ethyl-4H-1,2,4-triazole-3-thiol CAS 31405-23-9

Description

Compared with other compounds in its class, the molecular weight of 253.75 g/mol gives 5-(4-Chlorobenzyl)-4-ethyl-4H-1,2,4-triazole-3-thiol distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

5-(4-Chlorobenzyl)-4-ethyl-4H-1,2,4-triazole-3-thiol (CAS 31405-23-9) is a high-purity analytical reference standard with the molecular formula C11H12ClN3S and a molecular weight of 253.75 g/mol.

Structurally, 5-(4-Chlorobenzyl)-4-ethyl-4H-1,2,4-triazole-3-thiol (C11H12ClN3S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 7.0, corresponding to approximately 7 ring(s) or double-bond equivalent(s). With a molecular weight of 253.75 g/mol, it falls into the medium-molecular-weight range. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

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

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