2-Thiocarbamoyl-pyrrolidine-1-carboxylic acid tert-butyl ester CAS 864958-51-0
| CAS No. | 864958-51-0 |
| Molecular Formula | C10H18N2O2S |
| Molecular Weight | 230.33 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 2-Thiocarbamoyl-pyrrolidine-1-carboxylic acid tert-butyl ester is closely related to an amide group, a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
2-Thiocarbamoyl-pyrrolidine-1-carboxylic acid tert-butyl ester (CAS 864958-51-0), molecular formula C10H18N2O2S and molecular weight 230.33 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C10H18N2O2S, 2-Thiocarbamoyl-pyrrolidine-1-carboxylic acid tert-butyl ester contains an amide group, a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 230.33 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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).
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.
As a certified reference material (CRM), 2-Thiocarbamoyl-pyrrolidine-1-carboxylic acid tert-butyl ester 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 | C10H18N2O2S |
| Molecular Weight | 230.33 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) | 3.0 |
| UV Absorption | UV-absorbing |
| CAS Registry Year (est.) | 1987 |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
Related Thiocarbamoyl Standards
Recommended Standards
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- 1-(1-Methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl)ethanone (CAS 1446786-31-7)
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