2-(4-Fluorophenyl)-4-(4-nitrobenzyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile CAS 478048-46-3
| CAS No. | 478048-46-3 |
| Molecular Formula | C17H10FN5O4 |
| Molecular Weight | 367.29 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
2-(4-Fluorophenyl)-4-(4-nitrobenzyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile (C17H10FN5O4) contains a flavonoid core, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. It is notably hygroscopic, halogen substitution raises its density and boiling point, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
CATO supplies 2-(4-Fluorophenyl)-4-(4-nitrobenzyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile (CAS 478048-46-3), a certified reference material (molecular formula C17H10FN5O4, MW 367.29 g/mol) for analytical method development and quality control.
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 2-(4-Fluorophenyl)-4-(4-nitrobenzyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carbonitrile 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 | C17H10FN5O4 |
| Molecular Weight | 367.29 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor) |
| 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) | 15.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 5 |
Related Fluorophenyl Standards
- 4-(4-Fluorophenyl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide (CAS 1024120-50-0)
- 2-(4-(4-Fluorophenyl)piperazin-1-yl)-N-(2,4,5-trifluorophenyl)acetamide (CAS 720667-95-8)
- 4-(2-Fluorophenyl)-N-[3-(trifluoromethyl)phenyl]tetrahydro-1(2H)-pyrazinecarboxamide (CAS 401578-03-8)
- N4-(4-fluorophenyl)-3-chloro-5-(2-chlorophenyl)isothiazole-4-carboxamide (CAS 680212-81-1)
- 2-(2-(4-(4-Fluorophenyl)piperazin-1-yl)-2-oxoethyl)isoindoline-1,3-dione (CAS 53646-64-3)
- 1-(4-Fluorophenyl)-3-(3-(6-oxo-3-(pyridin-4-yl)pyridazin-1(6H)-yl)propyl)urea (CAS 1105208-68-1)
- 1-(2-Fluorophenyl)-3-(3-(6-oxo-3-(pyridin-4-yl)pyridazin-1(6H)-yl)propyl)urea (CAS 1105246-58-9)
- 3-(4-Fluorophenyl)-5-(2-phenylpyrimidin-4-yl)-2,1-benzoxazole (CAS 338772-67-1)
Recommended Standards
- 1-(3-(Trifluoromethyl)-1H-pyrazol-1-yl)-3-((4-(trifluoromethyl)benzyl)amino)propan-2-ol (CAS 680594-01-8)
- Benzo[d]isoxazol-3-yl diphenyl phosphate (CAS 94820-31-2)
- tert-butyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydro-1,4-benzoxazine-4-carboxylate (CAS 1467057-57-3)
- N,N-Bis(2-Chloroethyl)-4-[(4-Fluoro-2-Methylphenyl)Iminomethyl]-3-Methylaniline (CAS 2024-08-0)
- 2-(4-(3-(Trifluoromethoxy)phenyl)pyridin-2-yl)acetamide (CAS 1853166-29-6)
- 9-((Tetrahydrofuran-2-yl)methyl)-1H-purin-6(9H)-one (CAS 937599-88-7)
- Isopropyl (2S)-7-Cyano-4-(pyridin-2-ylmethyl)-1,2,3,4-tetrahydrocyclopenta[b]indol-2-ylcarbamate (CAS 1029692-15-6)
- 5-Acetyl-2-bromobenzoic acid (CAS 1612219-56-3)
- 1-ethyl-1-ethynyl-cyclopropane (CAS 2101782-55-0)
- 3-Methyl-n-(piperidin-4-yl)pyridin-2-amine trihydrochloride (CAS 1779129-90-6)
- 2-Piperazin-1-ylbenzamide (CAS 179480-81-0)
- 2,4,6-trimethylpyrimidine-5-carbaldehyde (CAS 90905-56-9)
- Ethyl 5-methyl-1H-pyrrolo[2,3-c]pyridine-2-carboxylate (CAS 800401-90-5)
- Semaglutide impurity 45 (CAS CATO-C4X-222645)
Why CATO?
- ISO 17034 accredited reference material producer (CNAS + ANAB dual accreditation)
- 130,000+ catalog items in stock, COA supplied with every batch
- Worldwide shipping with full export documentation (HS code guidance available)
- Technical support: +86 18665070610 / Nicole.chen@cato-chem.com