HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 573833Generated: October 26, 2026
Cesium carbonate → HCID 90405153, compound
https://huagongshe.com/reaction/573833
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Cesium carbonate | HCID 10796 | — |
| Reactant | Methyl bromoacetate | HCID 60984 | — |
| Reactant | Sodium Acetate | HCID 517045 | — |
| Reactant | (2-(Propan-2-yl)phenyl)thiourea | HCID 2759507 | — |
| Reactant | Thiobiuret | HCID 3034336 | — |
| Reactant | HCID 90404087 | HCID 90404087 | — |
| Solvent | Ethanol | HCID 702 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Solvent | Ethyl Acetate | HCID 8857 | — |
| Product | HCID 90405153 | HCID 90405153 | 62% |
Reaction Steps
3-(4-(1-(4-(Trifluoromethoxy)phenyl)-1H-1,2,4-triazol-3-yl)phenyl)propanoyl azide (C34) (0.24 g, 0.59 mmol) in acetonitrile (2.9 mL) was heated at 80° C. for 2 hours. The reaction was cooled and cesium carbonate (0.29 g, 0.88 mmol) and 1-(2-isopropylphenyl)thiourea (0.14 g, 0.70 mmol) were added. The reaction was stirred at room temperature overnight. LC/MS showed formation of the thiobiuret was complete. The reaction mixture was diluted with ethanol (2.9 mL) and sodium acetate (0.19 g, 2.4 mmol) and methyl 2-bromoacetate (0.12 mL, 1.2 mmol) were added. The solution was heated at 65° C. for 2 hours. The reaction was diluted with ethyl acetate and washed with water. The organic layer was dried over anhydrous sodium sulfate, filtered, concentrated, and loaded onto a Celite® cartridge with dichloromethane. Purification by flash column chromatography using 0-100% ethyl acetate/B, where B=1:1 dichloromethane/hexanes, as eluent afforded the title compound as a tan oil (0.22 g, 62%).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US09029560B2 |
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| Source dataset | uspto-grants-2015_05 |
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| ORD ID | ord-a2e0acf7dcf5425cbc4e9078be621e16 |
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| Source note | uspto-grants-2015_05 |
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