3-(4-(4-Bromophenyl)-5-((3-methylbenzyl)thio)-4H-1,2,4-triazol-3-yl)pyridine CAS 678971-55-6
| CAS No. | 678971-55-6 |
| Molecular Formula | C21H17BrN4S |
| Molecular Weight | 437.36 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Owing to a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, bromine substitution, 3-(4-(4-Bromophenyl)-5-((3-methylbenzyl)thio)-4H-1,2,4-triazol-3-yl)pyridine is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 437.36 g/mol — guide the selection of appropriate sample preparation and analytical techniques. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
3-(4-(4-Bromophenyl)-5-((3-methylbenzyl)thio)-4H-1,2,4-triazol-3-yl)pyridine (CAS 678971-55-6) is a high-purity analytical reference standard with the molecular formula C21H17BrN4S and a molecular weight of 437.36 g/mol.
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 | C21H17BrN4S |
| Molecular Weight | 437.36 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) | 15.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1985 |
| Halogen Content | Br-containing |
| Nitrogen Atoms | 4 |
| Sulfur Atoms | 1 |
Related Bromophenyl Standards
- 3-(4-(4-Bromophenyl)-5-((2-methylbenzyl)thio)-4H-1,2,4-triazol-3-yl)pyridine (CAS 477330-59-9)
- 3-(4-(4-Bromophenyl)-5-((4-methylbenzyl)thio)-4H-1,2,4-triazol-3-yl)pyridine (CAS 477333-41-8)
- 4-(4-(4-Bromophenyl)-5-((2-methylbenzyl)thio)-4H-1,2,4-triazol-3-yl)pyridine (CAS 477333-28-1)
- 4-(4-(4-Bromophenyl)-5-((3-methylbenzyl)thio)-4H-1,2,4-triazol-3-yl)pyridine (CAS 477330-90-8)
- 4-(4-(4-Bromophenyl)-5-((4-methylbenzyl)thio)-4H-1,2,4-triazol-3-yl)pyridine (CAS 477330-38-4)
- 2-(3-Bromophenyl)-N-isopropyl-4,4-dimethyl-1,2,3,4-tetrahydroquinoline-6-sulfonamide (CAS 1391609-03-2)
- 4-(2-(4-Bromophenyl)-6,6-dimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-1-yl)benzamide (CAS 1022288-07-8)
- 2-(4-Bromophenyl)-N'-[(1E)-(4-fluorophenyl)methylidene]imidazo[1,2-a]pyridine-6-carbohydrazide (CAS 866138-01-4)
Recommended Standards
- 2-(4-Chlorophenyl)-3-((4-(3-chlorophenyl)piperazin-1-yl)methyl)imidazo[1,2-a]pyridine (CAS 861212-34-2)
- 3-Amino-5-((3-carboxy-4-hydroxyphenyl)(3-carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl)-2-hydroxybenzoic acid (CAS 857024-60-3)
- (3-((3S,4S)-4-Amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl)-6-(2,3-dichlorophenyl)-5-methylpyrazin-2-yl)methanol (CAS 2172651-73-7)
- 4-(2,4-Dichlorophenyl)-6-(4-methylphenyl)-2-(4-methylpiperazin-1-yl)pyridine-3-carbonitrile (CAS 303984-85-2)
- N-Isopropyl-5-methylisoxazol-4-amine (CAS 403793-46-4)
- 1,2,3,4-Tetrahydronaphthalene-1,2-diamine (CAS 90872-69-8)
- 3-Methyl-2-morpholinobutanenitrile (CAS 409108-65-2)
- 2,6-Difluoro-4-formylbenzoic acid (CAS 1242070-98-9)
- 2-(1-ethyl-1H-1,3-benzodiazol-2-yl)ethan-1-amine dihydrochloride 910395-61-8 NE26846 (CAS 910395-61-8)
- 2-Bromo-4-fluoro-3-methylbenzonitrile (CAS 1805592-75-9)
- (R)-1-(5-Fluoro-2-iodophenyl)ethan-1-ol (CAS 1454852-98-2)
- Ethyl 1-cyanopyrrolo[2,1-a]isoquinoline-3-carboxylate (CAS 128353-03-7)
- n-(5-Fluoro-2-methylphenyl)-2-(n-hydroxyimino)acetamide (CAS 1846567-77-8)
- Semaglutide Impurity 166 (CAS 1395881-03-4)
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