3-Allyl-1-(4-(pyrrolidin-1-yl)but-2-yn-1-yl)quinazoline-2,4(1H,3H)-dione oxalate CAS 23905-27-3
| CAS No. | 23905-27-3 |
| Molecular Formula | C19H21N3O2 |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
3-Allyl-1-(4-(pyrrolidin-1-yl)but-2-yn-1-yl)quinazoline-2,4(1H,3H)-dione oxalate (CAS 23905-27-3), molecular formula C19H21N3O2C2H2O4 and molecular weight 413.43 g/mol, is a CATO reference standard with documented purity and traceability.
The molecular framework of 3-Allyl-1-(4-(pyrrolidin-1-yl)but-2-yn-1-yl)quinazoline-2,4(1H,3H)-dione oxalate (C19H21N3O2C2H2O4) is characterized by a flavonoid core, an amide group, a hydroxyl group, an ether linkage. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing 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).
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.
Physical & Chemical Properties
| Molecular Formula | C19H21N3O2 C2H2O4 |
| Molecular Weight | 413.43 g/mol |
| Appearance | Pale yellow to yellow crystalline powder |
| Purity | 97%+ |
| Storage | Store in a cool place (≤25°C), protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening |
| Degree of Unsaturation (DBE) | 12.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1963 |
| Nitrogen Atoms | 3 |
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