2,2,3,3,4,4-Hexadeuteriopentanedinitrile CAS 1346598-53-5
| CAS No. | 1346598-53-5 |
| Molecular Formula | - |
| Molecular Weight | 100.15 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 2,2,3,3,4,4-Hexadeuteriopentanedinitrile is closely related to deuterium isotope labeling, a nitrile group in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
2,2,3,3,4,4-Hexadeuteriopentanedinitrile (CAS 1346598-53-5) is a high-purity analytical reference standard with the molecular formula C5D6N2 and a molecular weight of 100.15 g/mol.
Based on its molecular formula C5D6N2, 2,2,3,3,4,4-Hexadeuteriopentanedinitrile contains deuterium isotope labeling, a nitrile group; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 100.15 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
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 | C5D6N2 |
| Molecular Weight | 100.15 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 7.0 |
| UV Absorption | UV-absorbing |
| CAS Registry Year (est.) | 1991 |
| Nitrogen Atoms | 2 |
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