N-(5-((2-Amino-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)benzamide CAS 868975-09-1
| CAS No. | 868975-09-1 |
| Molecular Formula | C12H9F3N4O2S2 |
| Molecular Weight | 362.35 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Based on its molecular formula C12H9F3N4O2S2, N-(5-((2-Amino-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)benzamide contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 362.35 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
N-(5-((2-Amino-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)benzamide (CAS 868975-09-1) is a high-purity analytical reference standard with the molecular formula C12H9F3N4O2S2 and a molecular weight of 362.35 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), N-(5-((2-Amino-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)benzamide 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 | C12H9F3N4O2S2 |
| Molecular Weight | 362.35 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; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 9.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 4 |
| Sulfur Atoms | 2 |
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Recommended Standards
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- SGA360 (CAS 680611-86-3)
- Ethyl 5-cyano-6-(4-fluorophenoxy)-2-phenylnicotinate (CAS 306980-17-6)
- 2-(5-Bromopyridin-2-yl)-2-methylpropan-1-amine (CAS 1370600-82-0)
- (3aS,4S,6aS)-rel-2-Boc-octahydro-cyclopenta[c]pyrrol-4-carboxylic acid (CAS 1251012-45-9)
- 4-(Hydroxymethyl)quinoline (CAS 6281-32-9)
- (2-Bromo-4,5-difluorophenyl)boronic acid (CAS 849062-34-6)
- Avibactam Impurity 159 (CAS CATO-C4X-1348159)
- Methyl 1-(p-tolyl)hydrazinecarboxylate (CAS 694431-61-3)
- 5-(3-Chlorophenyl)-4-isobutyl-4H-1,2,4-triazole-3-thiol (CAS 26028-64-8)
- Linaclotide Impurity 28 (CAS CATO-C4X-210628)
- 6-hydrazino-N-isopropylpyridine-3-sulfonamide (CAS 926243-85-8)
- Crustacean Cardioactive Peptide (CCAP) (CAS 309247-84-5)
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