(1R,2R,6S)-4-(4-Chlorophenyl)-7-oxa-4,8-diazatricyclo[6.4.0.0^{2,6}]dodecane-3,5-dione CAS 318239-72-4
| CAS No. | 318239-72-4 |
| Molecular Formula | C15H15ClN2O3 |
| Molecular Weight | 306.74 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO supplies (1R,2R,6S)-4-(4-Chlorophenyl)-7-oxa-4,8-diazatricyclo[6.4.0.0^{2,6}]dodecane-3,5-dione (CAS 318239-72-4), a certified reference material (molecular formula C15H15ClN2O3, MW 306.74 g/mol) for analytical method development and quality control.
(1R,2R,6S)-4-(4-Chlorophenyl)-7-oxa-4,8-diazatricyclo[6.4.0.0^{2,6}]dodecane-3,5-dione (C15H15ClN2O3) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. It is notably hygroscopic, 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. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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 | C15H15ClN2O3 |
| Molecular Weight | 306.74 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor) |
| Purity | 97%+ |
| Storage | Store at 2-8°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; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 9.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 2 |
Recommended Standards
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