Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 2-Propanethiol | HCID 6364 | — |
| Reactant | Potassium Carbonate | HCID 11430 | — |
| Reactant | 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbaldehyde | HCID 1478459 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | HCID 59739585 | HCID 59739585 | 102.4% |
Reaction Steps
Potassium carbonate (1.68 g, 12 mmol) was suspended in DMF (50 ml) and isopropylthiol (1 ml, 11 mmol) added. The suspension was stirred at room temperature for 15 minutes before a solution of 5-chloro-1-methyl-3-trifluoromethyl-1H-pyrazole-4-carbaldehyde (2.12 g, 10 mmol) in DMF (5 ml) was added. The reaction was stirred at room temperature for 16 hours. The reaction was partitioned between aqueous ammonium chloride solution and diethyl ether and the two phases were separated. The organic phase was washed with water and brine, dried over sodium sulfate and concentrated to give the product (2.584 g, 100% yield) which was used without further purification. 1H NMR (400 MHz, CDCl3): 1.29 (3H, s, Me), 1.31 (3H, s, Me), 3.52 (1H, heptet, CH), 4.02 (3H, s, Me), 10.03 (1H, s, CH).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08680290B2 |
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| Source dataset | uspto-grants-2014_03 |
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| ORD ID | ord-e5a51810f8be47bfb99dcd9c5fa7f55f |
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| Source note | uspto-grants-2014_03 |
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