| CAS No. | 68239-29-2 |
| Molecular Formula | - |
| Molecular Weight | 194.12 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Compared with other compounds in its class, the molecular weight of 194.12 g/mol gives Benzene-1,2,3,4,5-d5, 6-(1-bromoethyl-1,2,2,2-d4)- distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
Benzene-1,2,3,4,5-d5, 6-(1-bromoethyl-1,2,2,2-d4)- (CAS 68239-29-2), molecular formula C8D9Br and molecular weight 194.12 g/mol, is a CATO reference standard with documented purity and traceability.
Owing to deuterium isotope labeling, bromine substitution, an aromatic ring system, Benzene-1,2,3,4,5-d5, 6-(1-bromoethyl-1,2,2,2-d4)- is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 194.12 g/mol — guide the selection of appropriate sample preparation and analytical techniques. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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.
| Molecular Formula | C8D9Br |
| Molecular Weight | 194.12 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 tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 8.5 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1976 |
| Halogen Content | Br-containing |