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Ethanol → 1-(4-(3-(4-Fluoro-phenyl)cinnamoylamino)benzyl)piperidine

HRID 2151790
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HRID 2151790 반응식
[B:26]([O-:27])([O-:35])[O:36][c:28]1[cH:29][cH:30][c:31]([F:34])[cH:32][cH:33]1.[Br:1][c:2]1[cH:3][c:4]([CH:5]=[CH:6][C:7](=[O:8])[NH:9][c:10]2[cH:11][cH:12][c:13]([CH2:14][N:15]3[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]3)[cH:21][cH:22]2)[cH:23][cH:24][cH:25]1.[C:37](=[O:38])([O-:39])[O-:40].[CH3:43][CH2:44][OH:45].[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[K+:41].[K+:42]>>[c:2]1(-[c:28]2[cH:29][cH:30][c:31]([F:34])[cH:32][cH:33]2)[cH:3][c:4]([CH:5]=[CH:6][C:7](=[O:8])[NH:9][c:10]2[cH:11][cH:12][c:13]([CH2:14][N:15]3[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]3)[cH:21][cH:22]2)[cH:23][cH:24][cH:25]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 702EthanolHCID 813Potassium Cation2회HCID 1140TolueneHCID 19660Carbonate IonHCID 539077661-(4-(3-Bromocinnamoylamino)benzyl)piperidineHCID 867561584-Fluorophenyl borate

생성물 1

HCID 53967771
1-(4-(3-(4-Fluoro-phenyl)cinnamoylamino)benzyl)piperidine

출처 및 근거

ORD 기록
ord-87cec21cf7fb4c43ab0f055c6bce7fed
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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