3-(Methylthio)-5-(trifluoromethyl)-4h-1,2,4-triazol-4-amine CAS 164352-65-2
| CAS No. | 164352-65-2 |
| Molecular Formula | C4H5F3N4S |
| Molecular Weight | 198.17 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The molecular framework of 3-(Methylthio)-5-(trifluoromethyl)-4h-1,2,4-triazol-4-amine (C4H5F3N4S) is characterized by a nitrile group, sulfur-containing functionality, fluorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. 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).
3-(Methylthio)-5-(trifluoromethyl)-4h-1,2,4-triazol-4-amine (CAS 164352-65-2) is a high-purity analytical reference standard with the molecular formula C4H5F3N4S and a molecular weight of 198.17 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.
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 Formula | C4H5F3N4S |
| Molecular Weight | 198.17 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 3.0 |
| UV Absorption | UV-absorbing |
| CAS Registry Year (est.) | 2003 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 4 |
| Sulfur Atoms | 1 |
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Recommended Standards
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- (Z)-2-(3-(Methoxymethoxy)allyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (CAS 77896-98-1)
- 2-Bromoimidazo[1,2-α]pyridine (CAS 112581-95-0)
- 2-Amino-3-(benzophenone-4-carboxamido)-propanoic Acid (CAS 1219200-12-0)
- 3-(4-Aminopiperidin-1-yl)-1-(4-fluorophenyl)pyrazin-2(1H)-one (CAS 1713174-94-7)
- 2-(2-((1H-Indol-3-yl)methyl)-4-(tert-butoxycarbonyl)piperazin-1-yl)acetic acid (CAS 1060813-85-5)
- Benzyl 3-((2-amino-N-methylacetamido)methyl)piperidine-1-carboxylate (CAS 1353959-86-0)
- N-Methyloxazolo[5,4-d]pyrimidin-7-amine (CAS 31010-40-9)
- n-(3-Aminophenyl)-2,2-dimethylpropanamide (CAS 41402-58-8)
- Semaglutide Impurity 161 (x TFA Salt) (CAS CATO-C4X-2226161)
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