Tert-butyl N-(3-cyano-4-oxo-6,7-dihydro-5H-benzothiophen-2-yl)carbamate CAS 2891993-43-2
| CAS No. | 2891993-43-2 |
| Molecular Formula | C14H16N2O3S |
| Molecular Weight | 292.35 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
CATO supplies Tert-butyl N-(3-cyano-4-oxo-6,7-dihydro-5H-benzothiophen-2-yl)carbamate (CAS 2891993-43-2), a certified reference material (molecular formula C14H16N2O3S, MW 292.35 g/mol) for analytical method development and quality control.
The molecular framework of Tert-butyl N-(3-cyano-4-oxo-6,7-dihydro-5H-benzothiophen-2-yl)carbamate (C14H16N2O3S) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).
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 | C14H16N2O3S |
| Molecular Weight | 292.35 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) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2004 |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
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