| CAS No. | 63216-00-2 |
| Molecular Formula | C9H9BrO3S |
| Molecular Weight | 277.13 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Compared with other compounds in its class, the molecular weight of 277.13 g/mol gives methyl 2-[(4-bromobenzene)sulfinyl]acetate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
methyl 2-[(4-bromobenzene)sulfinyl]acetate (CAS 63216-00-2) is a high-purity analytical reference standard with the molecular formula C9H9BrO3S and a molecular weight of 277.13 g/mol.
methyl 2-[(4-bromobenzene)sulfinyl]acetate (C9H9BrO3S) contains a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, bromine substitution, an aromatic ring system. 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.
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 | C9H9BrO3S |
| Molecular Weight | 277.13 g/mol |
| Purity | 97%+ |
| Storage | Store in a cool place (≤25°C), keep sealed and dry, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in methanol, ethanol, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 5.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1975 |
| Halogen Content | Br-containing |
| Sulfur Atoms | 1 |