3-(2-Methyl-5-phenylbenzo[d]oxazol-3-ium-3-yl)propane-1-sulfonate CAS 66142-15-2
| CAS No. | 66142-15-2 |
| Molecular Formula | C17H17NO4S |
| Molecular Weight | 331.39 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 3-(2-Methyl-5-phenylbenzo[d]oxazol-3-ium-3-yl)propane-1-sulfonate is closely related to a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
3-(2-Methyl-5-phenylbenzo[d]oxazol-3-ium-3-yl)propane-1-sulfonate (CAS 66142-15-2) is a high-purity analytical reference standard with the molecular formula C17H17NO4S and a molecular weight of 331.39 g/mol.
Based on its molecular formula C17H17NO4S, 3-(2-Methyl-5-phenylbenzo[d]oxazol-3-ium-3-yl)propane-1-sulfonate contains a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 331.39 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.
As a certified reference material (CRM), 3-(2-Methyl-5-phenylbenzo[d]oxazol-3-ium-3-yl)propane-1-sulfonate 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.
Physical & Chemical Properties
| Molecular Formula | C17H17NO4S |
| Molecular Weight | 331.39 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO, water (slightly soluble) |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1975 |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
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