2-{[5-(4-chlorophenoxymethyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid CAS 862901-00-6
| CAS No. | 862901-00-6 |
| Molecular Formula | C16H14ClN3O4S |
| Molecular Weight | 379.82 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 379.82 g/mol gives 2-{[5-(4-chlorophenoxymethyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
CATO supplies 2-{[5-(4-chlorophenoxymethyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid (CAS 862901-00-6), a certified reference material (molecular formula C16H14ClN3O4S, MW 379.82 g/mol) for analytical method development and quality control.
Owing to a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, chlorine substitution, 2-{[5-(4-chlorophenoxymethyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 379.82 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.
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 | C16H14ClN3O4S |
| Molecular Weight | 379.82 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 11.0 |
| 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 chlorophenoxymethyl Standards
- 5-(4-Chlorophenoxymethyl)-4-(4-ethoxyphenyl)-4h-1,2,4-triazole-3-thiol (CAS 73216-27-0)
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- 5-(4-Chlorophenoxymethyl)-4-(4-methoxyphenyl)-4h-1,2,4-triazole-3-thiol (CAS 69026-64-8)
- 1-(3-{[5-(2-chlorophenoxymethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propyl)-2,3-dihydro-1H-1,3-benzodiazol-2-one (CAS 949847-41-0)
- 2-[2-(4-chlorophenoxymethyl)-1h-1,3-benzodiazol-1-yl]acetohydrazide (CAS 750599-05-4)
- 5-(4-Chlorophenoxymethyl)-4-cyclohexyl-4h-1,2,4-triazole-3-thiol (CAS 328556-86-1)
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Recommended Standards
- 2-(Bromomethyl)-3,6-dibromo-4-(difluoromethyl)pyridine (CAS 1806786-43-5)
- 2-Chloro-N-(2-(3-(furan-2-yl)-6-oxopyridazin-1(6H)-yl)ethyl)benzenesulfonamide (CAS 946340-47-2)
- 1-Benzyl-3-ethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-sulfonyl chloride (CAS 1334146-91-6)
- 3-Chloro-4-(2,5-dioxo-3-(o-tolyl)imidazolidin-1-yl)benzenesulfonamide (CAS 65513-52-2)
- 91000-53-2 N-[Ey(oC(1/4)x>>u)(1/4)x>>u]-3- degrees +/->>u+/-u>>CEa AAE-(1/4)ONI N-tris(Hydroxymethyl)methyl-3-aminopropanesulfonic acid sodium-potassium salt [(2-Hydroxy-1,1-bis(hydroxymethyl)ethyl)amino]-1-propanesulfonic acid sodium-potassium salt [(2-oC>>u-1,1- paragraph signthorn(oC(1/4)x>>u)OO>>u) degrees +/->>u]-1-+/-u>>CEa AAE-(1/4)ONI potassium 3-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}propane-1-sulfonate sodium 3-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}propane-1-sulfonate (CAS 91000-53-2)
- 2-(4-Chlorophenyl)-6-methylpyrimidin-4-amine (CAS 83702-19-6)
- 7,8-Dimethyl-[1,2,4]triazolo[1,5-c]pyrimidine (CAS 69141-90-8)
- 2,6-Dicyclopropylpyrimidine-4-carboxylic acid (CAS 1550853-40-1)
- 4-(((tert-Butyldimethylsilyl)oxy)methyl)-2-(2-hydroxypropan-2-yl)thiazole-5-sulfonamide (CAS 2271371-48-1)
- 3-(Triethylsilyl)propiolic acid (CAS 17865-01-9)
- 1-(4-Chlorophenyl)-2-cyclobutylquinazolin-4(1H)-one (CAS 95216-42-5)
- 2,2-Difluoro-3-Hydroxy-1-Phenyl-4-Penten-1-One (CAS 209474-41-9)
- Insulin Degludec Impurity 10 (CAS CATO-C4X-215710)
- Peptide Impurity 12 (CAS CATO-CPTD788812)
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