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Potassium Cation → [{4-(methoxycarbonyl)-1H-pyrazole-1-yl}methyl](3,3,3-trifluoropropyl) malononitrile

HRID 2341025
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HRID 2341025 반응식
[C:23](=[O:24])([O-:25])[O-:26].[CH3:30][N:31]([CH3:32])[CH:33]=[O:34].[Cl:1][CH2:2][n:3]1[n:4][cH:5][c:6]([C:8](=[O:9])[O:10][CH3:11])[cH:7]1.[F:12][C:13]([CH2:14][CH2:15][CH:16]([C:17]#[N:18])[C:19]#[N:20])([F:21])[F:22].[K+:27].[K+:28].[OH2:29]>>[CH2:2]([n:3]1[n:4][cH:5][c:6]([C:8](=[O:9])[O:10][CH3:11])[cH:7]1)[C:16]([CH2:15][CH2:14][C:13]([F:12])([F:21])[F:22])([C:17]#[N:18])[C:19]#[N:20]
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7

반응물 6

HCID 813Potassium Cation2회HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 7017727methyl 1-(chloromethyl)-1H-pyrazole-4-carboxylateHCID 221857612-(3,3,3-Trifluoropropyl)malononitrile

생성물 1

HCID 86760867[{4-(methoxycarbonyl)-1H-pyrazole-1-yl}methyl](3,3,3-trifluoropropyl) malononitrile

출처 및 근거

ORD 기록
ord-c4764c88905a4a9db1414e661e986e3b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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