5-(4-Tert-butylphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol CAS 175276-75-2
| CAS No. | 175276-75-2 |
| Molecular Formula | C13H17N3S |
| Molecular Weight | 247.36 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
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 5-(4-Tert-butylphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol (CAS 175276-75-2), a certified reference material (molecular formula C13H17N3S, MW 247.36 g/mol) for analytical method development and quality control.
The molecular framework of 5-(4-Tert-butylphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol (C13H17N3S) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
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 Formula | C13H17N3S |
| Molecular Weight | 247.36 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2007 |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 1 |
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