(S)-2-((4-Chloro-6-((3-fluorophenyl)amino)pyrimidin-2-yl)amino)-4-methylpentanoic acid CAS 825647-52-7
| CAS No. | 825647-52-7 |
| Molecular Formula | C16H18ClFN4O2 |
| Molecular Weight | 352.79 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of (S)-2-((4-Chloro-6-((3-fluorophenyl)amino)pyrimidin-2-yl)amino)-4-methylpentanoic acid is closely related to a nitrogen-containing heterocyclic scaffold, 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.
(S)-2-((4-Chloro-6-((3-fluorophenyl)amino)pyrimidin-2-yl)amino)-4-methylpentanoic acid (CAS 825647-52-7) is a high-purity analytical reference standard with the molecular formula C16H18ClFN4O2 and a molecular weight of 352.79 g/mol.
Based on its molecular formula C16H18ClFN4O2, (S)-2-((4-Chloro-6-((3-fluorophenyl)amino)pyrimidin-2-yl)amino)-4-methylpentanoic acid contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 352.79 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
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 (S)-2-((4-Chloro-6-((3-fluorophenyl)amino)pyrimidin-2-yl)amino)-4-methylpentanoic acid 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 | C16H18ClFN4O2 |
| Molecular Weight | 352.79 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, low volatility) |
| 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) | 9.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1986 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 4 |
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Recommended Standards
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