4-Allyl-5-(1-(4-chloro-3,5-dimethylphenoxy)ethyl)-4H-1,2,4-triazole-3-thiol CAS 956576-82-2
| CAS No. | 956576-82-2 |
| Molecular Formula | C15H18ClN3OS |
| Molecular Weight | 323.84 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 323.84 g/mol gives 4-Allyl-5-(1-(4-chloro-3,5-dimethylphenoxy)ethyl)-4H-1,2,4-triazole-3-thiol distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
4-Allyl-5-(1-(4-chloro-3,5-dimethylphenoxy)ethyl)-4H-1,2,4-triazole-3-thiol (CAS 956576-82-2), molecular formula C15H18ClN3OS and molecular weight 323.84 g/mol, is a CATO reference standard with documented purity and traceability.
4-Allyl-5-(1-(4-chloro-3,5-dimethylphenoxy)ethyl)-4H-1,2,4-triazole-3-thiol (C15H18ClN3OS) contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, 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. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO manufactures 4-Allyl-5-(1-(4-chloro-3,5-dimethylphenoxy)ethyl)-4H-1,2,4-triazole-3-thiol under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C15H18ClN3OS |
| Molecular Weight | 323.84 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) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 1 |
Related Allyl Standards
- 4-Allyl-5-[3-(4-chloro-2-methylphenoxy)propyl]-4H-1,2,4-triazole-3-thiol (CAS 956576-80-0)
- N-allyl-3-(4-chlorophenyl)-5-(methylthio)thiophene-2-carboxamide (CAS 477858-01-8)
- N-Allyl-2-((1-(5-chloro-2-methylphenyl)-1H-tetrazol-5-yl)thio)acetamide (CAS 878702-55-7)
- 4-Allyl-5-(biphenyl-2-yloxymethyl)-4H-[1,2,4]triazole-3-thiol (CAS 722464-03-1)
- N1-Allyl-N2-(2-morpholino-2-(thiophen-3-yl)ethyl)oxalamide (CAS 946200-95-9)
- 1-Allyl-N-ethyl-2-imino-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide (CAS 371235-40-4)
- N-Allyl-1-ethyl-2-imino-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide (CAS 371143-97-4)
- 5-(4-Allyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)-1-benzylpyridin-2(1H)-one (CAS 242472-13-5)
Recommended Standards
- 4-((4-Chloro-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)methyl)morpholine (CAS 721414-43-3)
- 2-(Piperidin-1-yl)ethyl 3-chlorobenzo[b]thiophene-2-carboxylate (CAS 282091-68-3)
- 5-(4-Chlorophenoxymethyl)-4-cyclohexyl-4h-1,2,4-triazole-3-thiol (CAS 328556-86-1)
- 2-((2-(Tert-butylthio)ethyl)amino)-3-chloronaphthalene-1,4-dione (CAS 866008-89-1)
- 2-Benzyl-5-methyl-2H-pyrazol-3-ol (CAS 946-23-6)
- 2,5-dioxopyrrolidin-1-yl 2-methoxyacetate (CAS 161742-67-2)
- 4-Thiomorpholinomethyl-3-trifluoromethyl-benzophenone (CAS 898782-98-4)
- 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-((2-(trimethylsilyl)ethoxy)methyl)isoquinolin-1(2H)-one (CAS 2818961-76-9)
- 2,5,6,7-Tetrahydro-3H-cyclopenta[c]pyridazin-3-one (CAS 122001-78-9)
- [(8-Chloro-4-oxo-1,2,3,4-tetrahydrocyclopenta-[c]chromen-7-yl)oxy]acetic acid (CAS 326102-27-6)
- 2-(Pyridin-3-ylcarbamoyl)benzoic acid (CAS 38370-61-5)
- 3-(3,4-Dimethylphenyl)-3-hydroxypropanenitrile (CAS 1226148-28-2)
- (5-(Methoxymethyl)-4-methyl-4H-1,2,4-triazol-3-yl)methanol (CAS 1546458-31-4)
- Semaglutide Impurity 192 (CAS CATO-C4X-2226192)
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