Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 238561생성일: 2026년 10월 25일
Potassium Carbonate → (R)-2-(4-cyano-2-methyl-3-(trifluoromethyl)phenylamino)-3-hydroxy-3-methylbutanoic acid
https://huagongshe.com/reaction/238561
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|
| 반응물 | Potassium Carbonate | HCID 11430 | — |
| 반응물 | 3-Methyl-D-threonine | HCID 2724755 | — |
| 반응물 | 4-Fluoro-3-methyl-2-(trifluoromethyl)benzonitrile | HCID 66624938 | — |
| 용매 | Dimethyl Sulfoxide | HCID 679 | — |
| 생성물 | (R)-2-(4-cyano-2-methyl-3-(trifluoromethyl)phenylamino)-3-hydroxy-3-methylbutanoic acid | HCID 66624722 | 97% |
반응 단계
4-fluoro-3-methyl-2-(trifluoromethyl)benzonitrile (763 mg, 3.76 mmol) was mixed together with (R)-2-amino-3-hydroxy-3-methylbutanoic acid (500 mg, 3.76 mmol) in DMSO (25 mL). K2CO3 (1.56 g, 11.28 mmol) was added to the reaction mixture and the reaction mixture stirred at 85° C. for 18 h. The reaction mixture was allowed to cool to room temperature, quenched with H2O (25 mL) and extracted with EtOAc (2×30 mL). The aqueous layer was then acidified with solid citric acid and extracted with EtOAc (2×80 mL). The later organic extracts were combined, washed with H2O (2×30 mL), dried (Na2SO4), filtered and concentrated under reduced pressure to provided the title compound as a yellow solid (1.15 g, 97%): 1H NMR (400 MHz, d6-acetone, δ in ppm) 7.63 (d, J=9 Hz, 1H), 6.97 (d, J=9 Hz, 1H), 5.62 (d, J=9 Hz, 1H), 4.20 (d, J=9 Hz, 1H), 2.33 (s, 3H), 1.43 (s, 3H) and 1.42 (s, 3H).
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US08642632B2 |
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| 출처 데이터셋 | uspto-grants-2014_02 |
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| ORD ID | ord-85118c7de333478b8df4fef83b50dd1d |
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| 출처 메모 | uspto-grants-2014_02 |
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