| CAS No. | 106511-81-3 |
| Molecular Formula | C9H5N3OS2 |
| Molecular Weight | 235.29 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 2-Thioxo-5H-1,3,4-thiadiazolo[2,3-b]quinazolin-5-one.
2-Thioxo-5H-1,3,4-thiadiazolo[2,3-b]quinazolin-5-one (CAS 106511-81-3), molecular formula C9H5N3OS2 and molecular weight 235.29 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C9H5N3OS2, 2-Thioxo-5H-1,3,4-thiadiazolo[2,3-b]quinazolin-5-one contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 235.29 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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.
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 | C9H5N3OS2 |
| Molecular Weight | 235.29 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) | 9.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 2 |