Hydrochloric Acid → 1-(2',4'-difluoro[1,1'-biphenyl]-3-yl)-1-(1H-imidazol-4-yl)-2-methyl-1-propanol

반응식

[ClH:44].[F:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]([C:15]([CH:16]([CH3:17])[CH3:18])([OH:19])[c:20]3[n:21][cH:22][n:23]([C:25]([c:26]4[cH:27][cH:28][cH:29][cH:30][cH:31]4)([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[c:38]4[cH:39][cH:40][cH:41][cH:42][cH:43]4)[cH:24]3)[cH:12][cH:13][cH:14]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1.[n:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[F:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]([C:15]([CH:16]([CH3:17])[CH3:18])([OH:19])[c:20]3[n:21][cH:22][nH:23][cH:24]3)[cH:12][cH:13][cH:14]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 1049Pyridine

HCID 18668569HCID 18668569, 화합물

생성물 1

HCID 1784501311-(2',4'-difluoro[1,1'-biphenyl]-3-yl)-1-(1H-imidazol-4-yl)-2-methyl-1-propanol

출처 및 근거

ORD 기록: ord-f646d4284d8247dfa5b107e38144ee68
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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