2-chloro-1,3-benzothiazin-4-one CAS 7742-71-4
| CAS No. | 7742-71-4 |
| Molecular Formula | C8H12ClNOS |
| Molecular Weight | 205.70 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
2-chloro-1,3-benzothiazin-4-one (CAS 7742-71-4) is a high-purity analytical reference standard with the molecular formula C8H12ClNOS and a molecular weight of 205.70 g/mol.
Owing to an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, chlorine substitution, 2-chloro-1,3-benzothiazin-4-one is typically white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 205.70 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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.
Physical & Chemical Properties
| Molecular Formula | C8H12ClNOS |
| Molecular Weight | 205.70 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO, water (slightly soluble) |
| 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.) | 1959 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
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