| CAS No. | 1208077-77-3 |
| Molecular Formula | C7H6BrFS |
| Molecular Weight | 221.09 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Compared with other compounds in its class, the molecular weight of 221.09 g/mol gives 4-Bromo-5-fluoro-2-methylbenzenethiol distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
4-Bromo-5-fluoro-2-methylbenzenethiol (CAS 1208077-77-3) is a high-purity analytical reference standard with the molecular formula C7H6BrFS and a molecular weight of 221.09 g/mol.
Owing to sulfur-containing functionality, fluorine/bromine substitution, an aromatic ring system, 4-Bromo-5-fluoro-2-methylbenzenethiol is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes ā including a molecular weight of 221.09 g/mol ā guide the selection of appropriate sample preparation and analytical techniques. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).
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 | C7H6BrFS |
| Molecular Weight | 221.09 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO |
| Stability | May oxidize slowly on prolonged air exposure |
| Degree of Unsaturation (DBE) | 4.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1990 |
| Halogen Content | F/Br-containing |
| Sulfur Atoms | 1 |