5-Acetyl-3-allyl-1-((3-chloro-5-(trifluoromethyl)pyridin-2-yl)(methyl)amino)pyrimidine-2,4(1H,3H)-dione CAS 338399-63-6
| CAS No. | 338399-63-6 |
| Molecular Formula | C16H14ClF3N4O3 |
| Molecular Weight | 402.76 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
5-Acetyl-3-allyl-1-((3-chloro-5-(trifluoromethyl)pyridin-2-yl)(methyl)amino)pyrimidine-2,4(1H,3H)-dione (CAS 338399-63-6), molecular formula C16H14ClF3N4O3 and molecular weight 402.76 g/mol, is a CATO reference standard with documented purity and traceability.
5-Acetyl-3-allyl-1-((3-chloro-5-(trifluoromethyl)pyridin-2-yl)(methyl)amino)pyrimidine-2,4(1H,3H)-dione (C16H14ClF3N4O3) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine 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 manufactures 5-Acetyl-3-allyl-1-((3-chloro-5-(trifluoromethyl)pyridin-2-yl)(methyl)amino)pyrimidine-2,4(1H,3H)-dione 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 | C16H14ClF3N4O3 |
| Molecular Weight | 402.76 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store in a cool place (≤25°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) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 4 |
Related Acetyl Standards
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Recommended Standards
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