HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1752368Generated: October 28, 2026
1,3-Dichloroacetone → 1-{[4-(Chloromethyl)-1,3-thiazol-2-yl]methyl}-4-methylpiperazine hydrochloride
https://huagongshe.com/reaction/1752368
Participants
| Role | Name | HCID | Charge |
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| Reactant | 1,3-Dichloroacetone | HCID 10793 | — |
| Reactant | Thionyl Chloride | HCID 24386 | — |
| Reactant | Sodium Bicarbonate | HCID 516892 | — |
| Reactant | 2-(4-Methylpiperazin-1-yl)ethanethioamide | HCID 24692624 | — |
| Solvent | Chloroform | HCID 6212 | — |
| Product | 1-{[4-(Chloromethyl)-1,3-thiazol-2-yl]methyl}-4-methylpiperazine hydrochloride | HCID 66838611 | 107.2% |
Reaction Steps
2-(4-Methylpiperazin-1-yl)ethanethioamide (0.438 g, 2.53 mmol), 1,3-dichloroacetone (0.355 g, 2.78 mmol) and sodium bicarbonate (0.236 g, 2.78 mmol) was stirred in chloroform (4 mL) at room temperature for 48 h. The reaction mixture was filtered and the filter cake was washed with chloroform. The filtrate was added dropwise to a cooled (ice bath) solution of thionyl chloride (0.205 mL, 2.78 mmol) in chloroform (2 mL). The solution was stirred at 60° C. for 0.5 h and then cooled to room temperature. The brown mixture was filtered and washed with chloroform to afford 1-{[4-(chloromethyl)-1,3-thiazol-2-yl]methyl}-4-methylpiperazine hydrochloride as a brown solid (0.421 g, 1.49 mmol, 59% yield). 1H NMR (400 MHz; D2O): 2.89 (s, 3H); 3.18-3.43 (m, 4H); 3.56-3.78 (m, 4H); 4.56 (s, 2H); 4.67 (s, 2H); 7.66 (s, 1H); MS (EI) for C10H16ClN3S: 246 (MH+).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US09163006B2 |
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| Source dataset | uspto-grants-2015_10 |
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| ORD ID | ord-51ef3b82ec344807894de8827a0d1361 |
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| Source note | uspto-grants-2015_10 |
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