| CAS No. | 448190-45-2 |
| Molecular Formula | C12H7ClN4O2 |
| Molecular Weight | 274.66 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Compared with other compounds in its class, the molecular weight of 274.66 g/mol gives 3-(Benzo[d][1,3]dioxol-5-yl)-6-chloro-[1,2,4]triazolo[4,3-b]pyridazine distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
3-(Benzo[d][1,3]dioxol-5-yl)-6-chloro-[1,2,4]triazolo[4,3-b]pyridazine (CAS 448190-45-2) is a high-purity analytical reference standard with the molecular formula C12H7ClN4O2 and a molecular weight of 274.66 g/mol.
3-(Benzo[d][1,3]dioxol-5-yl)-6-chloro-[1,2,4]triazolo[4,3-b]pyridazine (C12H7ClN4O2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. It is notably hygroscopic, halogen substitution raises its density and boiling point, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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 | C12H7ClN4O2 |
| Molecular Weight | 274.66 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry, 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; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 11.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 4 |