9-Benzyl 4-(tert-butyl) 1,4,9-triazaspiro[5.5]Undecane-4,9-dicarboxylate CAS 1639963-87-3
| CAS No. | 1639963-87-3 |
| Molecular Formula | C21H31N3O4 |
| Molecular Weight | 389.49 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 9-Benzyl 4-(tert-butyl) 1,4,9-triazaspiro[5.5]Undecane-4,9-dicarboxylate.
9-Benzyl 4-(tert-butyl) 1,4,9-triazaspiro[5.5]Undecane-4,9-dicarboxylate (CAS 1639963-87-3), molecular formula C21H31N3O4 and molecular weight 389.49 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C21H31N3O4, 9-Benzyl 4-(tert-butyl) 1,4,9-triazaspiro[5.5]Undecane-4,9-dicarboxylate contains a flavonoid core, an amide group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 389.49 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).
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 | C21H31N3O4 |
| Molecular Weight | 389.49 g/mol |
| Appearance | Pale yellow to yellow crystalline powder |
| 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 |
| Degree of Unsaturation (DBE) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1993 |
| Nitrogen Atoms | 3 |
Recommended Standards
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