5-(Aminomethyl)-4-(3-(trifluoromethyl)phenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione CAS 865546-31-2
| CAS No. | 865546-31-2 |
| Molecular Formula | C10H9F3N4S |
| Molecular Weight | 274.27 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 5-(Aminomethyl)-4-(3-(trifluoromethyl)phenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is closely related to a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
5-(Aminomethyl)-4-(3-(trifluoromethyl)phenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione (CAS 865546-31-2) is a high-purity analytical reference standard with the molecular formula C10H9F3N4S and a molecular weight of 274.27 g/mol.
Owing to a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution, 5-(Aminomethyl)-4-(3-(trifluoromethyl)phenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 274.27 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.
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), 5-(Aminomethyl)-4-(3-(trifluoromethyl)phenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione 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 | C10H9F3N4S |
| Molecular Weight | 274.27 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.) | 1987 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 4 |
| Sulfur Atoms | 1 |
Related Aminomethyl Standards
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- 4-(Aminomethyl)-4-(3,4-dichlorophenyl)cyclohexanol (CAS 887978-44-1)
- (S)-2-((2-(Aminomethyl)quinazolin-4-yl)amino)-3-methylbutanamide (CAS 920032-98-0)
- 1-(Boc-aminomethyl)-3-(5-tetrazolyl)benzene (CAS 1398534-55-8)
- 2-(4-(Aminomethyl)phenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol (CAS 1263078-73-4)
- (3-(Aminomethyl)pyrrolidin-1-yl)(2,6-dichlorophenyl)methanone (CAS 1833237-72-1)
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Recommended Standards
- 5-(3-Quinolinyl)-1H-indole-2,3-dione (CAS 893737-69-4)
- 5-(Benzyloxy)-1,2-dimethyl-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid (CAS 389130-68-1)
- 5-((3-(trifluoromethyl)benzyl)thio)-4H-1,2,4-triazol-3-amine (CAS 303150-56-3)
- 5-(Benzyloxy)-3-(difluoromethyl)-1H-pyrrolo[2,3-c]pyridine (CAS 2149597-58-8)
- 2-(Difluoromethyl)-3-fluoroanisole (CAS 1214358-22-1)
- 2-(4-(Ethoxycarbonyl)piperazine-1-carbonyl)cyclohexane-1-carboxylic acid (CAS 650588-19-5)
- 1-(1-Methyl-1,4,5,6-tetrahydropyrimidin-2-yl)guanidine (CAS 740028-48-2)
- Urapidil Impurity 53 (CAS CATO-C4X-192453)
- 5-(2-Bromo-6-chloro-3-methylphenyl)oxazole (CAS 2364584-61-0)
- Cinacalcet Impurity 102 (CAS 133469-32-6(free base))
- 2-(3-Hydroxyazetidin-1-yl)-1-(pyrrolidin-1-yl)ethan-1-one (CAS 1343065-02-0)
- 5-(Ethylthio)-1-isopropyl-1H-1,2,4-triazol-3(2H)-one (CAS 55375-82-1)
- N-[4-(tert-Butyl)benzyl]-3-(3-phenylpropoxy)-aniline (CAS 1040690-48-9)
- D-β-Asp15-Tirzepatide (CAS CATO-CPTD788930)
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