Methyl 4-bromo-3-fluorothiophene-2-carboxylate CAS 395664-56-9
| CAS No. | 395664-56-9 |
| Molecular Formula | C6H4BrFO2S |
| Molecular Weight | 239.06 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 239.06 g/mol gives Methyl 4-bromo-3-fluorothiophene-2-carboxylate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
Methyl 4-bromo-3-fluorothiophene-2-carboxylate (CAS 395664-56-9) is a high-purity analytical reference standard with the molecular formula C6H4BrFO2S and a molecular weight of 239.06 g/mol.
The molecular framework of Methyl 4-bromo-3-fluorothiophene-2-carboxylate (C6H4BrFO2S) is characterized by a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine/bromine substitution, an aromatic ring system. In reversed-phase chromatography, its retention is governed primarily by the polarity and ionization state of its functional groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
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.
Physical & Chemical Properties
| Molecular Formula | C6H4BrFO2S |
| Molecular Weight | 239.06 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO, water (slightly soluble) |
| Stability | May oxidize slowly on prolonged air exposure; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 4.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F/Br-containing |
| Sulfur Atoms | 1 |
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