3-(2-Chlorophenyl)-4-methyl-5-(methylthio)-4H-1,2,4-triazole CAS 116850-67-0
| CAS No. | 116850-67-0 |
| Molecular Formula | C10H10ClN3S |
| Molecular Weight | 239.72 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 3-(2-Chlorophenyl)-4-methyl-5-(methylthio)-4H-1,2,4-triazole.
CATO supplies 3-(2-Chlorophenyl)-4-methyl-5-(methylthio)-4H-1,2,4-triazole (CAS 116850-67-0), a certified reference material (molecular formula C10H10ClN3S, MW 239.72 g/mol) for analytical method development and quality control.
Based on its molecular formula C10H10ClN3S, 3-(2-Chlorophenyl)-4-methyl-5-(methylthio)-4H-1,2,4-triazole contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 239.72 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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 | C10H10ClN3S |
| Molecular Weight | 239.72 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| 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) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1990 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 1 |
Related Chlorophenyl Standards
- 4-(4-Chlorophenyl)-2,5-dimethyl-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 142989-12-6)
- [2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]methanol (CAS 317319-22-5)
- 2-(2-(4-Chlorophenyl)thiazol-4-yl)ethanol (CAS 27473-03-6)
- 3-(4-Chlorophenyl)-4-methyl-5-(methylthio)-4H-1,2,4-triazole (CAS 57295-58-6)
- 3-(4-Chlorophenyl)-5-(ethylthio)-1H-1,2,4-triazole (CAS 56381-67-0)
- 4-(4-Chlorophenyl)-2-hydrazinyl-5-methylthiazole (CAS 886494-29-7)
- 5-(2-Chlorophenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol (CAS 26029-13-0)
- 5-(2-Chlorophenyl)-N-ethyl-1,3,4-thiadiazol-2-amine (CAS 35313-93-0)
Recommended Standards
- n-((1,2,3-Thiadiazol-4-yl)methyl)-2-chloro-4-methylaniline (CAS 1157063-08-5)
- 2-Chloro-3-(((1-methyl-1h-imidazol-2-yl)thio)methyl)pyridine (CAS 1247737-08-1)
- n-((1,2,3-Thiadiazol-4-yl)methyl)-1-(4-chlorophenyl)methanamine (CAS 1157062-61-7)
- (1-Acetylpiperidin-3-yl)methanesulfonyl chloride (CAS 1248643-89-1)
- Cyclohexyl 3-methylbutanoate (CAS 7774-44-9)
- N-(2,4-Dichlorophenyl)-3,4-dihydro-2H-pyrrol-5-amine (CAS 51170-87-7)
- 3-Amino-3-(3,4,5-trimethoxyphenyl)propanoic acid (CAS 34841-00-4)
- 1-(4-Fluorophenyl)hex-5-yn-2-ol (CAS 29229-62-7)
- N-ethyl-1-ethynylcyclohexan-1-amine (CAS 14465-49-7)
- tert-Butyl 2-methyl-3-[(pentan-3-yl)amino]propanoate (CAS 1221342-45-5)
- (2-Bromo-4-(methylsulfonyl)phenyl)hydrazine (CAS 849035-73-0)
- N-[6-Chloro-4-(trifluoromethyl)-2-pyridyl]-N'-(3-methylphenyl)urea (CAS 256471-18-8)
- 1-methanesulfonylcyclopropane-1-carboxylic acid (CAS 1249197-58-7)
- Tyr-Proinsulin C-Peptide (55-89) (human) (CAS 139532-11-9)
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