| CAS No. | 1827645-31-7 |
| Molecular Formula | C7H6F6O3 |
| Molecular Weight | 252.11 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
The occurrence of ETHYL 4,4,4-TRIFLUORO-3-OXO-2-(TRIFLUOROMETHYL)BUTANOATE is closely related to a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
ETHYL 4,4,4-TRIFLUORO-3-OXO-2-(TRIFLUOROMETHYL)BUTANOATE (CAS 1827645-31-7) is a high-purity analytical reference standard with the molecular formula C7H6F6O3 and a molecular weight of 252.11 g/mol.
Based on its molecular formula C7H6F6O3, ETHYL 4,4,4-TRIFLUORO-3-OXO-2-(TRIFLUOROMETHYL)BUTANOATE contains a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine substitution; these features give the compound characteristic functional-group stretching vibrations in infrared spectroscopy. The molecular weight of 252.11 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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.
As a certified reference material (CRM), ETHYL 4,4,4-TRIFLUORO-3-OXO-2-(TRIFLUOROMETHYL)BUTANOATE meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
| Molecular Formula | C7H6F6O3 |
| Molecular Weight | 252.11 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, water |
| Stability | Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 2.0 |
| CAS Registry Year (est.) | 1995 |
| Halogen Content | F-containing |