| CAS No. | 318951-76-7 |
| Molecular Formula | C20H15ClF3N5O |
| Molecular Weight | 433.81 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
The occurrence of 2-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)-5,5'-dimethyl-2'-phenyl-1',2'-dihydro-2H,3'H-[3,4'-bipyrazol]-3'-one is closely related to a steroid core, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
CATO supplies 2-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)-5,5'-dimethyl-2'-phenyl-1',2'-dihydro-2H,3'H-[3,4'-bipyrazol]-3'-one (CAS 318951-76-7), a certified reference material (molecular formula C20H15ClF3N5O, MW 433.81 g/mol) for analytical method development and quality control.
The molecular framework of 2-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)-5,5'-dimethyl-2'-phenyl-1',2'-dihydro-2H,3'H-[3,4'-bipyrazol]-3'-one (C20H15ClF3N5O) is characterized by a steroid core, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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.
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 | C20H15ClF3N5O |
| Molecular Weight | 433.81 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, low volatility) |
| 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) | 14.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 5 |