| CAS No. | 299918-83-5 |
| Molecular Formula | C6H3F3N4O |
| Molecular Weight | 204.11 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Based on its molecular formula C6H3F3N4O, 5-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one contains an amide group, a hydroxyl group, an ether linkage, fluorine substitution, an aromatic ring system; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 204.11 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
5-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one (CAS 299918-83-5) is a high-purity analytical reference standard with the molecular formula C6H3F3N4O and a molecular weight of 204.11 g/mol.
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.
| Molecular Formula | C6H3F3N4O |
| Molecular Weight | 204.11 g/mol |
| Appearance | Off-white to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor, low volatility) |
| 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) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 4 |