4-Bromobicyclo[2.2.2]octane-1-carbaldehyde CAS 94994-27-1
| CAS No. | 94994-27-1 |
| Molecular Formula | C9H13BrO |
| Molecular Weight | 217.10 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Structurally, 4-Bromobicyclo[2.2.2]octane-1-carbaldehyde (C9H13BrO) contains a hydroxyl group, an ether linkage, bromine substitution. The molecule exhibits a degree of unsaturation (DBE) of 3.0, corresponding to approximately 3 ring(s) or double-bond equivalent(s). With a molecular weight of 217.10 g/mol, it falls into the medium-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
4-Bromobicyclo[2.2.2]octane-1-carbaldehyde (CAS 94994-27-1), molecular formula C9H13BrO and molecular weight 217.10 g/mol, is a CATO reference standard with documented purity and traceability.
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 | C9H13BrO |
| Molecular Weight | 217.10 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO, water (slightly soluble) |
| Stability | May oxidize slowly on prolonged air exposure |
| Degree of Unsaturation (DBE) | 3.0 |
| UV Absorption | UV-absorbing |
| CAS Registry Year (est.) | 1984 |
| Halogen Content | Br-containing |
Related Bromobicyclo Standards
- 1-Bromobicyclo[3.3.1]nonan-3-one (CAS 66077-98-3)
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