Methyl 3-((4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)propanoate CAS 514180-96-2
| CAS No. | 514180-96-2 |
| Molecular Formula | C15H12F4N2O2S |
| Molecular Weight | 360.33 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
As a certified reference material (CRM), Methyl 3-((4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)propanoate meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
CATO supplies Methyl 3-((4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)propanoate (CAS 514180-96-2), a certified reference material (molecular formula C15H12F4N2O2S, MW 360.33 g/mol) for analytical method development and quality control.
Based on its molecular formula C15H12F4N2O2S, Methyl 3-((4-(4-fluorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl)thio)propanoate contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 360.33 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).
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.
Physical & Chemical Properties
| Molecular Formula | C15H12F4N2O2S |
| Molecular Weight | 360.33 g/mol |
| 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.) | 1984 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
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Recommended Standards
- 1-(5,7-Dimethyl-1,8-Naphthyridin-2-yl-1-[3-(Trifluoromethyl)Phenyl]Urea (CAS 288309-94-4)
- N',2-dimethyl-N'-(3-(trifluoromethyl)quinoxalin-2-yl)benzohydrazide (CAS 338773-26-5)
- (Z)-1-(3-morpholino-5-(trifluoromethyl)pyridin-2-yl)ethan-1-one O-dimethylcarbamoyl oxime (CAS 860650-98-2)
- N',4-dimethyl-N'-(3-(trifluoromethyl)quinoxalin-2-yl)benzohydrazide (CAS 343372-50-9)
- 2-(Pyridin-3-yloxy)isoindoline-1,3-dione (CAS 1079392-30-5)
- 2-(Chloromethyl)-2,3-dihydro-1h-indene (CAS 1260801-96-4)
- 2-Amino-4-(3-bromo-4-fluorophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile (CAS 331951-05-4)
- N-(5-bromopyridin-2-yl)butyramide (CAS 148612-12-8)
- 5-Bromo-4-chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine (CAS 2773490-24-5)
- Calcium peroxide (CAS 1305-79-9)
- Octahydro-1H-4,7-methanopyrazolo[3,4-d]pyridazine (CAS 507236-80-8)
- 2-(Aminomethyl)-6-chlorophenol (CAS 1243282-04-3)
- 2-(3,4,5-Trimethoxyphenyl)imidazole (CAS 1119531-23-5)
- Semaglutide Impurity 13 (CAS CATO-C4X-222613)
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