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Acetate → 4-(4-Chloro-phenyl)-3-methoxycarbonylmethyl-piperazine-1-carboxylic acid tert-butyl ester

HRID 1122963
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HRID 1122963 반응식
[C:11]([CH3:12])([CH3:13])([CH3:14])[O:15][C:16](=[O:17])[N:18]1[CH2:19][CH:20]([CH2:24][C:25](=[O:26])[O:27][CH3:28])[NH:21][CH2:22][CH2:23]1.[C:38]([O-:39])(=[O:40])[CH3:41].[C:43]([O-:44])(=[O:45])[CH3:46].[Cl:1][c:2]1[cH:3][cH:4][c:5]([B:8]([OH:9])[OH:10])[cH:6][cH:7]1.[Cl:35][CH2:36][Cl:37].[Cu+2:42].[cH:29]1[cH:30][cH:31][n:32][cH:33][cH:34]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:21]2[CH:20]([CH2:24][C:25](=[O:26])[O:27][CH3:28])[CH2:19][N:18]([C:16]([O:15][C:11]([CH3:12])([CH3:13])[CH3:14])=[O:17])[CH2:23][CH2:22]2)[cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 175Acetate2회HCID 1049PyridineHCID 6344DichloromethaneHCID 27099Cupric cationHCID 742994-Chlorophenylboronic acidHCID 2756816Methyl 4-Boc-piperazine-2-acetate

생성물 1

HCID 66758668
4-(4-Chloro-phenyl)-3-methoxycarbonylmethyl-piperazine-1-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-9b24484d21b949cbaca5174d2ca011c8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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