N-[3,5-Bis(trifluoromethyl)phenyl]-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]acetamide CAS 329929-31-9
| CAS No. | 329929-31-9 |
| Molecular Formula | C17H11F6N5OS |
| Molecular Weight | 447.36 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of N-[3,5-Bis(trifluoromethyl)phenyl]-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]acetamide is closely related to a steroid core, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
N-[3,5-Bis(trifluoromethyl)phenyl]-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]acetamide (CAS 329929-31-9), molecular formula C17H11F6N5OS and molecular weight 447.36 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C17H11F6N5OS, N-[3,5-Bis(trifluoromethyl)phenyl]-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]acetamide contains a steroid core, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, fluorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 447.36 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO manufactures N-[3,5-Bis(trifluoromethyl)phenyl]-2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]acetamide under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C17H11F6N5OS |
| Molecular Weight | 447.36 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 12.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 5 |
| Sulfur Atoms | 1 |
Recommended Standards
- Ethyl 5-[2-(methoxycarbonyl)phenoxy]-3-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-6-carboxylate (CAS 338957-81-6)
- 2-Bromo-9-(naphthalen-2-yl)-9-phenyl-9H-fluorene (CAS 1345860-68-5)
- ethyl 2-(diethoxyphosphoryl)-3,3,3-trifluoro-2-[(phenylsulphonyl)amino]propanoate (CAS 256332-83-9)
- 9-Bromo-7,7-diphenyl-7H-benzo[c]fluorene (CAS 1384207-26-4)
- n-(2-Aminoethyl)-2-ethoxyacetamide (CAS 89909-96-6)
- 3-Amino-2-[(2-cyanophenyl)methyl]-1h-isoindol-2-ium chloride (CAS 400880-08-2)
- 1-[4-Amino-2-(trifluoromethyl)phenyl]-2-pyrrolidinone (CAS 69131-62-0)
- Methyl 2-bromo-4-(trifluoromethyl)thiazole-5-carboxylate (CAS 79247-82-8)
- 5-Bromo-1,3,4-thiadiazole-2-carbaldehyde (CAS 1547015-45-1)
- (2-(Methylsulfonyl)phenyl)hydrazine (CAS 704-42-7)
- Deshydroxyethoxy-2,3-O-(dimethylmethylene) Ticagrelor (CAS 274693-49-1)
- 3-Bromo-N-(2-butoxyethyl)aniline (CAS 1247147-26-7)
- 2-(2,2-Dimethylpyrrolidin-1-yl)acetonitrile (CAS 35018-16-7)
- Palmitoyl Tripeptide-1 TFA salt (CAS 2803375-47-3)
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