4-(4-Methylphenyl)-2-(methylsulfanyl)-6-{[3-(trifluoromethyl)phenyl]sulfanyl}pyrimidine-5-carbonitrile CAS 303985-01-5
| CAS No. | 303985-01-5 |
| Molecular Formula | C20H14F3N3S2 |
| Molecular Weight | 417.47 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 417.47 g/mol gives 4-(4-Methylphenyl)-2-(methylsulfanyl)-6-{[3-(trifluoromethyl)phenyl]sulfanyl}pyrimidine-5-carbonitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
CATO supplies 4-(4-Methylphenyl)-2-(methylsulfanyl)-6-{[3-(trifluoromethyl)phenyl]sulfanyl}pyrimidine-5-carbonitrile (CAS 303985-01-5), a certified reference material (molecular formula C20H14F3N3S2, MW 417.47 g/mol) for analytical method development and quality control.
Owing to a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution, 4-(4-Methylphenyl)-2-(methylsulfanyl)-6-{[3-(trifluoromethyl)phenyl]sulfanyl}pyrimidine-5-carbonitrile is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 417.47 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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).
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
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 | C20H14F3N3S2 |
| Molecular Weight | 417.47 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, 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) | 14.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 2 |
Related Methylphenyl Standards
- 4-Ethyl-3-{[(4-methylphenyl)methyl]sulfanyl}-5-{thieno[2,3-b]quinolin-2-yl}-4H-1,2,4-triazole (CAS 439112-39-7)
- {2-[(4-methylphenyl)sulfanyl]pyridin-3-yl}methyl N-[3-(trifluoromethyl)phenyl]carbamate (CAS 338413-60-8)
- {2-[(4-methylphenyl)sulfanyl]pyridin-3-yl}methyl N-(3,5-dichlorophenyl)carbamate (CAS 338413-54-0)
- 1-[(4-Methylphenyl)sulfanyl]-2-nitro-4-{[3-(trifluoromethyl)phenoxy]methyl}benzene (CAS 477869-59-3)
- N-(3-{4-[4-(4-methylphenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]piperidine-1-carbonyl}phenyl)acetamide (CAS 1775391-10-0)
- Methyl 4-[(4-methylphenyl)sulfanyl]-6-oxo-1-[3-(trifluoromethyl)phenyl]-1,6-dihydropyridazine-3-carboxylate (CAS 338395-80-5)
- 4-{[(4-methylphenyl)methyl]sulfanyl}-6-phenoxy-8-thia-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,5,9,11-hexaene (CAS 478030-11-4)
- 4-[(1Z)-3-(4-Methylphenyl)-3-oxoprop-1-en-1-yl]phenyl 2,4,6-trimethylbenzene-1-sulfonate (CAS 331461-34-8)
Recommended Standards
- 3-Fluoro-a-(2-methyl-1-oxopropyl)-?-oxo-N,ß-diphenyl-benzenebutanamide (CAS 1817798-20-1)
- N-[(1S,2S)-2,3-Dihydro-2-[(2-methoxy-6-methylphenyl)thio]-1H-inden-1-yl]-1,1,1-trifluoromethanesulfonamide (CAS 2102520-67-0)
- Boc-Gly-Gly-Gly-Lys-OH (CAS 250290-81-4)
- Citalopram Impurity 95 (CAS CATO-C4X-110995)
- 4-(4-Methoxyphenoxy)-2-(methylsulfanyl)thieno[3,2-d]pyrimidine (CAS 339018-91-6)
- N-(4-Cyanophenyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]-1,4-diazepane-1-carbothioamide (CAS 900019-60-5)
- 7-(4-Chlorophenyl)imidazo[1,2-a]pyrimidin-5(1H)-one (CAS 106263-56-3)
- 2-Amino-4-(trifluoromethyl)-5-pyrimidineboronic Acid (CAS 1045861-30-0)
- 4-(Methylthio)benzo[g]quinazoline (CAS 62574-40-7)
- (S)-N-(Pyrrolidin-3-yl)pyridine-2-sulfonamide hydrochloride (CAS 1354000-34-2)
- 3-Cyclopropyl-3-phenylprop-2-enoic acid (CAS 64701-93-5)
- 6-Chloro-3-(chloromethyl)imidazo[1,2-a]pyrimidine (CAS 944906-66-5)
- 1-(2-Chloroethyl)-3-(pyridin-3-yl)urea (CAS 13908-58-2)
- Des-Tyr10-Tirzepatide (CAS CATO-CPTD788680)
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