| CAS No. | 478067-77-5 |
| Molecular Formula | C20H19Cl2NOS |
| Molecular Weight | 392.34 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Compared with other compounds in its class, the molecular weight of 392.34 g/mol gives 3-(((4-(Tert-butyl)phenyl)thio)methyl)-5-(3,4-dichlorophenyl)isoxazole distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
3-(((4-(Tert-butyl)phenyl)thio)methyl)-5-(3,4-dichlorophenyl)isoxazole (CAS 478067-77-5), molecular formula C20H19Cl2NOS and molecular weight 392.34 g/mol, is a CATO reference standard with documented purity and traceability.
Owing to a steroid core, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, chlorine substitution, 3-(((4-(Tert-butyl)phenyl)thio)methyl)-5-(3,4-dichlorophenyl)isoxazole is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 392.34 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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.
The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.
| Molecular Formula | C20H19Cl2NOS |
| Molecular Weight | 392.34 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, 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) | 11.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |