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Bromide ion → (4-chloro-phenyl)-{4-[hydroxy-(1-trityl-1H-imidazol-4-yl)-methyl]-1-methyl-1H-pyrrol-2-yl}methanone

HRID 146784
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HRID 146784 반응식
[Br-:26].[CH2:27]([Mg+:28])[CH3:29].[CH3:51][CH2:52][O:53][CH2:54][CH3:55].[Cl:30][c:31]1[cH:32][cH:33][c:34]([C:35](=[O:36])[c:37]2[cH:38][c:39]([CH:43]=[O:44])[cH:40][n:41]2[CH3:42])[cH:45][cH:46]1.[Cl:48][CH2:49][Cl:50].[I:1][c:2]1[n:3][cH:4][n:5]([C:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:6]1.[OH2:47]>>[c:2]1([CH:43]([c:39]2[cH:38][c:37]([C:35]([c:34]3[cH:33][cH:32][c:31]([Cl:30])[cH:46][cH:45]3)=[O:36])[n:41]([CH3:42])[cH:40]2)[OH:44])[n:3][cH:4][n:5]([C:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:6]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 259Bromide ionHCID 962WaterHCID 3283Diethyl EtherHCID 6344DichloromethaneHCID 6182524-Iodo-1-tritylimidazoleHCID 224810525-(4-Chlorobenzoyl)-1-methyl-1H-pyrrole-3-carboxaldehydeHCID 178461628HCID 178461628, 화합물

생성물 1

HCID 22481044(4-chloro-phenyl)-{4-[hydroxy-(1-trityl-1H-imidazol-4-yl)-methyl]-1-methyl-1H-pyrrol-2-yl}methanone

출처 및 근거

ORD 기록
ord-5bf9f04ac0d54868b459a9dc181a9fc0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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