Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 279134생성일: 2026년 10월 26일
Methyl iodide → 3-(Benzo[1,3]dioxol-5-ylamino)-2-methanesulfonyl-3-methylsulfanyl-2-propenenitrile
https://huagongshe.com/reaction/279134
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|
| 반응물 | Methyl iodide | HCID 6328 | — |
| 반응물 | Potassium Carbonate | HCID 11430 | — |
| 반응물 | (Methylsulfonyl)acetonitrile | HCID 75283 | — |
| 반응물 | 1,3-Benzodioxole, 5-isothiocyanato- | HCID 123593 | — |
| 용매 | Acetone | HCID 180 | — |
| 생성물 | 3-(Benzo[1,3]dioxol-5-ylamino)-2-methanesulfonyl-3-methylsulfanyl-2-propenenitrile | HCID 70149585 | 65.4% |
반응 단계
A solution of methanesulfonylacetonitrile (2.85 g, 23.9 mmol) in dry acetone (50 ml) was stirred while dry potassium carbonate (6.61 g, 47.8 mmol) and 3,4-methylenedioxyphenyl isothiocyanate (4.50 g, 25.1 mmol) were added. The resulting mixture was stirred at room temperature under nitrogen for 20 h. Excess of potassium carbonate was filtered off, methyl iodide (4.43 ml, 71.8 mmol) was added to the filtrate, and stirring was continued for 4 h at 50° C. The mixture was evaporated and the residue was dissolved in dichloromethane and extracted with water and brine. The organic phase was dried over magnesium sulphate, filtered and evaporated to afford 4.88 g (65%) of the title compound as golden brown crystals. Mp 168-170° C.1H NMR (200 MHz, DMSO-d6): δ=2.30 (s, 3H), 3.33 (s, 3H), 6.06 (s, 2H), 6.79 (dd, 1H), 6.94 (d, 1H), 6.97 (d, 1H), 9.98 (br s, 1H).
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US06362205B1 |
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| 출처 데이터셋 | uspto-grants-2002_03 |
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| ORD ID | ord-27b4340d3d1442bdbf7c7fd30c7156c8 |
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| 출처 메모 | uspto-grants-2002_03 |
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