| CAS No. | 452323-95-4 |
| Molecular Formula | C7H8N4O |
| Molecular Weight | 164.16 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
The occurrence of 3,6-Dimethyl-[1,2,4]triazolo[4,3-c]pyrimidin-5(6H)-one is closely related to an amide group, a hydroxyl group, an ether linkage, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
3,6-Dimethyl-[1,2,4]triazolo[4,3-c]pyrimidin-5(6H)-one (CAS 452323-95-4), molecular formula C7H8N4O and molecular weight 164.16 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, 3,6-Dimethyl-[1,2,4]triazolo[4,3-c]pyrimidin-5(6H)-one (C7H8N4O) contains an amide group, a hydroxyl group, an ether linkage, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 6.0, corresponding to approximately 6 ring(s) or double-bond equivalent(s). With a molecular weight of 164.16 g/mol, it falls into the medium-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
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.
| Molecular Formula | C7H8N4O |
| Molecular Weight | 164.16 g/mol |
| Appearance | Off-white to pale yellow crystalline powder. (faint amine-like odor) |
| 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) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Nitrogen Atoms | 4 |