3-azabicyclo[3.2.1]octane-2,4-dione CAS 5763-45-1
| CAS No. | 5763-45-1 |
| Molecular Formula | C7H12N4O2S |
| Molecular Weight | 216.26 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
As a certified reference material (CRM), 3-azabicyclo[3.2.1]octane-2,4-dione 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.
3-azabicyclo[3.2.1]octane-2,4-dione (CAS 5763-45-1), molecular formula C7H12N4O2S and molecular weight 216.26 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, 3-azabicyclo[3.2.1]octane-2,4-dione (C7H12N4O2S) contains an amide group, a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 4.0, corresponding to approximately 4 ring(s) or double-bond equivalent(s). With a molecular weight of 216.26 g/mol, it falls into the medium-molecular-weight range. 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.
Physical & Chemical Properties
| Molecular Formula | C7H12N4O2S |
| Molecular Weight | 216.26 g/mol |
| 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) | 4.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1958 |
| Nitrogen Atoms | 4 |
| Sulfur Atoms | 1 |
Related azabicyclo Standards
- (7-Benzyl-7-azabicyclo[2.2.1]heptan-1-yl)methanamine (CAS 1193090-83-3)
- 3-Benzyl-3-azabicyclo[3.2.1]Octan-8-amine (CAS 166973-12-2)
- (2-Benzyl-2-azabicyclo[2.2.1]hept-7-yl)methanamine (CAS 404830-41-7)
- 8-benzyl-8-azabicyclo[3.2.1]octan-3-amine (CAS 96901-92-7)
- 6-Benzyl-6-azabicyclo[3.2.1]octan-3-one (CAS 16607-47-9)
- 3-Benzyl-3-azabicyclo[3.1.1]heptane-6-carbaldehyde (CAS 1935140-33-2)
- 3-Benzyl-3-azabicyclo[3.2.1]octan-6-one (CAS 833458-92-7)
- 3-Benzyl-3-azabicyclo[3.2.1]octan-8-one (CAS 83507-33-9)
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