N-(3-Bromo-4-fluorophenyl)-4-(trifluoromethyl)pyrimidin-2-amine CAS 1312536-71-2
| CAS No. | 1312536-71-2 |
| Molecular Formula | C11H6BrF4N3 |
| Molecular Weight | 336.08 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.
N-(3-Bromo-4-fluorophenyl)-4-(trifluoromethyl)pyrimidin-2-amine (CAS 1312536-71-2) is a high-purity analytical reference standard with the molecular formula C11H6BrF4N3 and a molecular weight of 336.08 g/mol.
Based on its molecular formula C11H6BrF4N3, N-(3-Bromo-4-fluorophenyl)-4-(trifluoromethyl)pyrimidin-2-amine contains a nitrogen-containing heterocyclic scaffold, a nitrile group, fluorine/bromine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 336.08 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).
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.
Physical & Chemical Properties
| Molecular Formula | C11H6BrF4N3 |
| Molecular Weight | 336.08 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 |
| 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) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1990 |
| Halogen Content | F/Br-containing |
| Nitrogen Atoms | 3 |
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