N-{2-[(4-bromophenyl)sulfanyl]ethyl}-3-(trifluoromethyl)benzamide CAS 338956-08-4
| CAS No. | 338956-08-4 |
| Molecular Formula | C16H13BrF3NOS |
| Molecular Weight | 404.24 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 404.24 g/mol gives N-{2-[(4-bromophenyl)sulfanyl]ethyl}-3-(trifluoromethyl)benzamide distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
N-{2-[(4-bromophenyl)sulfanyl]ethyl}-3-(trifluoromethyl)benzamide (CAS 338956-08-4), molecular formula C16H13BrF3NOS and molecular weight 404.24 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, N-{2-[(4-bromophenyl)sulfanyl]ethyl}-3-(trifluoromethyl)benzamide (C16H13BrF3NOS) contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, fluorine/bromine substitution. The molecule exhibits a degree of unsaturation (DBE) of 9.0, corresponding to approximately 9 ring(s) or double-bond equivalent(s). With a molecular weight of 404.24 g/mol, it falls into the moderately-high-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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), N-{2-[(4-bromophenyl)sulfanyl]ethyl}-3-(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 | C16H13BrF3NOS |
| Molecular Weight | 404.24 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 9.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F/Br-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Related N Standards
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Recommended Standards
- 3-Chloro-2-(2-{[(4-chlorophenyl)methyl]sulfanyl}-1H-imidazol-1-yl)-5-(trifluoromethyl)pyridine (CAS 338956-50-6)
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