2-{[(4-chlorophenyl)methyl]sulfanyl}-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine CAS 51646-16-3
| CAS No. | 51646-16-3 |
| Molecular Formula | C14H13ClN4S |
| Molecular Weight | 304.80 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 304.80 g/mol gives 2-{[(4-chlorophenyl)methyl]sulfanyl}-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
CATO supplies 2-{[(4-chlorophenyl)methyl]sulfanyl}-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine (CAS 51646-16-3), a certified reference material (molecular formula C14H13ClN4S, MW 304.80 g/mol) for analytical method development and quality control.
2-{[(4-chlorophenyl)methyl]sulfanyl}-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine (C14H13ClN4S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, chlorine 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. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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 | C14H13ClN4S |
| Molecular Weight | 304.80 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) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1971 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 4 |
| Sulfur Atoms | 1 |
Related chlorophenyl Standards
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Recommended Standards
- 3-(3-Chloropyrazin-2-yl)-N,N-dimethylpiperidine-1-sulfonamide (CAS 1361115-27-6)
- 4-(5-Chloro-[1,2,4]thiadiazol-3-yl)-piperazine-1-carboxylic acid tert-butyl ester (CAS 887623-94-1)
- 4-(3-Chloropyrazin-2-yl)-N,N-dimethylpiperidine-1-sulfonamide (CAS 1361115-04-9)
- 6-(Benzylthio)-9-(2-chloroethyl)-9H-purine (CAS 299-13-8)
- Cis-octahydrocycloocta[b]furan-2(3H)-one (CAS 19296-86-7)
- 2-(2,6,6-Trimethyl-2-cyclohexen-1-yl)ethanol (CAS 472-63-9)
- 4-Butylphenyl Isocyanate 69342-47-8 B3205 Isocyanic Acid 4-Butylphenyl Ester (CAS 69342-47-8)
- N-Cyclopentyl-2-[4-(5-ethyl-1,2,4-oxadiazol-3-yl)-1,3-dioxo-1H,2H,3H,5H,6H,7H,8H-pyrido[1,2-c]pyrimidin-2-yl]acetamide (CAS 1775386-86-1)
- 4-(2-Amino-2-methylpropyl)phenol (CAS 51706-55-9)
- 3-(piperazin-1-ylmethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine (CAS 923191-50-8)
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- 4-((Diisopropylamino)methyl)benzenethiol (CAS 1443329-51-8)
- Pancreatic Polypeptide (31-36), amide, human (CAS 74012-13-8)
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