2-(((1-Allyl-6-oxo-4-(trifluoromethyl)-1,6-dihydropyrimidin-2-yl)thio)methyl)benzonitrile CAS 866143-17-1
| CAS No. | 866143-17-1 |
| Molecular Formula | C16H12F3N3OS |
| Molecular Weight | 351.35 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
2-(((1-Allyl-6-oxo-4-(trifluoromethyl)-1,6-dihydropyrimidin-2-yl)thio)methyl)benzonitrile (C16H12F3N3OS) contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, fluorine substitution. Halogen substitution raises its density and boiling point, its high carbon-to-hydrogen ratio confers good lipid solubility; these physicochemical properties determine the optimal preparation and storage of its standard solutions. 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).
CATO supplies 2-(((1-Allyl-6-oxo-4-(trifluoromethyl)-1,6-dihydropyrimidin-2-yl)thio)methyl)benzonitrile (CAS 866143-17-1), a certified reference material (molecular formula C16H12F3N3OS, MW 351.35 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.
As a certified reference material (CRM), 2-(((1-Allyl-6-oxo-4-(trifluoromethyl)-1,6-dihydropyrimidin-2-yl)thio)methyl)benzonitrile 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.
Physical & Chemical Properties
| Molecular Formula | C16H12F3N3OS |
| Molecular Weight | 351.35 g/mol |
| 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) | 11.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 1 |
Related Allyl Standards
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Recommended Standards
- 1-Acetyl-1,2-dihydroquinoline-2-carbonitrile (CAS 57309-71-4)
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- 1-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-oxocyclobutane-1-carboxylic acid (CAS 2137820-81-4)
- 2-(3-Fluorobenzylidene)-6-phenyl-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione (CAS 606956-01-8)
- 2-Amino-2-oxoethyl 2-amino-5-hydroxybenzoate (CAS 473976-93-1)
- 6-Hydroxy-2a,2a1,5,5a,6,8a-hexahydro-2H-naphtho[1,8-bc]furan-2-one (CAS 91143-13-4)
- 3-[4-(trifluoromethyl)phenyl]-1,2-oxazole-5-carboxylic acid (CAS 901926-70-3)
- 5-Fluoro-6-iodo-1H-pyrrolo[2,3-b]pyridine (CAS 1228665-63-1)
- 6,7-Dihydro-4H-pyrazolo[5,1-c][1,4]thiazine-2-carboxylic acid (CAS 1253790-97-4)
- 3-(3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl)propanoic acid (CAS 500026-33-5)
- Potassium 4-(2-oxobenzo[cd]indol-1(2H)-yl)butane-1-sulfonate (CAS 1151666-52-2)
- 2-(3-Bromophenyl)pyrimidine (CAS 885468-36-0)
- 1-Methyl-1h-pyrazol-5-ol hydrochloride (CAS 33641-16-6)
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