3-(9,10-Dioxo-9,10-dihydroanthracene-2-carboxamido)propyl 2,2,2-trifluoroethane-1-sulfonate CAS 661461-84-3
| CAS No. | 661461-84-3 |
| Molecular Formula | C20H16F3NO6S |
| Molecular Weight | 455.40 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
3-(9,10-Dioxo-9,10-dihydroanthracene-2-carboxamido)propyl 2,2,2-trifluoroethane-1-sulfonate (CAS 661461-84-3), molecular formula C20H16F3NO6S and molecular weight 455.40 g/mol, is a CATO reference standard with documented purity and traceability.
3-(9,10-Dioxo-9,10-dihydroanthracene-2-carboxamido)propyl 2,2,2-trifluoroethane-1-sulfonate (C20H16F3NO6S) contains a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution. 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. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
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), 3-(9,10-Dioxo-9,10-dihydroanthracene-2-carboxamido)propyl 2,2,2-trifluoroethane-1-sulfonate 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.
Physical & Chemical Properties
| Molecular Formula | C20H16F3NO6S |
| Molecular Weight | 455.40 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO, water (slightly soluble) |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 12.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1985 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
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