4-Allyl-5-{[(1-naphthylmethyl)sulfanyl]methyl}-4h-1,2,4-triazole-3-thiol CAS 1160995-49-2
| CAS No. | 1160995-49-2 |
| Molecular Formula | C17H17N3S2 |
| Molecular Weight | 327.47 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
4-Allyl-5-{[(1-naphthylmethyl)sulfanyl]methyl}-4h-1,2,4-triazole-3-thiol (CAS 1160995-49-2), molecular formula C17H17N3S2 and molecular weight 327.47 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C17H17N3S2, 4-Allyl-5-{[(1-naphthylmethyl)sulfanyl]methyl}-4h-1,2,4-triazole-3-thiol contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 327.47 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
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 | C17H17N3S2 |
| Molecular Weight | 327.47 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 11.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1989 |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 2 |
Related Allyl Standards
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Recommended Standards
- Danazol Impurity 1 (CAS CATO-C4X-21321)
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- 2,4-Dimethyl-5-(6-((4-methylbenzyl)thio)pyridazin-3-yl)thiazole (CAS 896058-59-6)
- 3-Hydroxy-3-phenylisoindolin-1-one (CAS 6637-53-2)
- 2-Amino-2-methyl-3-(1h-pyrazol-1-yl)propanamide (CAS 1249366-88-8)
- 7-Methoxybenzo[c]isoxazole (CAS 122528-40-9)
- (His(3-Me)2)-TRH (CAS 34367-54-9)
- 1-Benzyl 1'-(tert-butyl) hexahydrospiro[indole-3,3'-piperidine]-1,1'(2H)-dicarboxylate (CAS 1823403-86-6)
- (3R,4S)-3-amino-4-chlorotetrahydrothiophene 1,1-dioxide (CAS 1820574-95-5)
- 5-(Cyclopropylmethyl)-4,5-dihydro-3H-spiro[benzo[b][1,4]oxazepine-2,4'-piperidine] (CAS 1298034-45-3)
- Vericiguat Impurity 20 (CAS CATO-C4X-289620)
- SRT1720 HCl (CAS 1001645-58-4)
- Tirzepatide Impurity 22 X TFA Salt (CAS CATO-C4X-324022)
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