Ethanol → 2-(2-Amino-4-chloro-phenoxy)-1-[4-(4-fluoro-benzyl)-2-methyl-piperazin-1-yl]-ethanone

HRID 2335312

반응식

[CH3:30][CH2:31][OH:32].[Cl:1][c:2]1[cH:3][c:4]([N+:27]([O-:28])=[O:29])[c:5]([O:6][CH2:7][C:8](=[O:9])[N:10]2[CH:11]([CH3:24])[CH2:12][N:13]([CH2:16][c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]3)[CH2:14][CH2:15]2)[cH:25][cH:26]1.[Pt:33](=[O:34])=[O:35]>>[Cl:1][c:2]1[cH:3][c:4]([NH2:27])[c:5]([O:6][CH2:7][C:8](=[O:9])[N:10]2[CH:11]([CH3:24])[CH2:12][N:13]([CH2:16][c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]3)[CH2:14][CH2:15]2)[cH:25][cH:26]1

참가 물질

반응물 3

HCID 702Ethanol

HCID 345198Adams' catalyst

HCID 219734872-(4-Chloro-2-nitrophenoxy)-1-[4-[(4-fluorophenyl)methyl]-2-methylpiperazin-1-yl]ethanone

생성물 1

HCID 114861502-(2-Amino-4-chloro-phenoxy)-1-[4-(4-fluoro-benzyl)-2-methyl-piperazin-1-yl]-ethanone

출처 및 근거

ORD 기록: ord-5a6d3a2f377f45c89ff88720e4311905
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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