Methyl 3-((tert-butoxycarbonyl)amino)-5-(2,2,2-trifluoroethyl)thiophene-2-carboxylate CAS 2163771-84-2
| CAS No. | 2163771-84-2 |
| Molecular Formula | C13H16F3NO4S |
| Molecular Weight | 339.33 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Structurally, Methyl 3-((tert-butoxycarbonyl)amino)-5-(2,2,2-trifluoroethyl)thiophene-2-carboxylate (C13H16F3NO4S) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 5.0, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 339.33 g/mol, it falls into the moderately-high-molecular-weight range. 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).
Methyl 3-((tert-butoxycarbonyl)amino)-5-(2,2,2-trifluoroethyl)thiophene-2-carboxylate (CAS 2163771-84-2) is a high-purity analytical reference standard with the molecular formula C13H16F3NO4S and a molecular weight of 339.33 g/mol.
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), Methyl 3-((tert-butoxycarbonyl)amino)-5-(2,2,2-trifluoroethyl)thiophene-2-carboxylate 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 | C13H16F3NO4S |
| Molecular Weight | 339.33 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; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 5.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1998 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Recommended Standards
- 5,7-Dimethoxy-2-(thiophen-2-yl)-4-(trifluoromethyl)quinoline (CAS 633315-43-2)
- Ald-Ph-amido-PEG3-C-COOH (CAS 1007215-91-9)
- 4-Methyl-2-({[3-(trifluoromethyl)phenyl]-sulfonyl}amino)pentanoic acid (CAS 251097-65-1)
- 1-(2-Fluorophenyl)-6-(thiophen-2-yl)-1h-pyrazolo[3,4-b]pyridine-4-carboxylic acid (CAS 1011398-29-0)
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- 5-bromo-2-(ethylsulfanyl)pyridine (CAS 127800-66-2)
- Colistin B (CAS 7239-48-7)
- 5-Methoxyquinolin-8-ol hydrochloride (CAS 57334-58-4)
- Tert-butyl (2,3-dibromopropyl)carbamate (CAS 1356492-89-1)
- 1,5-Dimethylimidazolidine-2,4-dione (CAS 17374-27-5)
- 2,3-Dibromo-6-(trifluoromethyl)pyridine (CAS 1159512-35-2)
- 2-Phenyl-1H-imidazole hydrochloride (CAS 34535-90-5)
- rel-(1R,2R)-2-(Methylthio)cyclopentanamine (CAS 6336-61-4)
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