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Water → 4-[2-(2-Methoxyethoxy)phenyl]-2,2-dimethyl-5-oxopiperazine-1-carboxylic acid t-butyl ester

HRID 1229946
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HRID 1229946 반응식
[C:37]([CH3:38])([CH3:39])([CH3:40])[O:41][C:42](=[O:43])[N:44]1[C:45]([CH3:58])([CH3:59])[CH2:46][N:47]([c:51]2[c:52]([OH:57])[cH:53][cH:54][cH:55][cH:56]2)[C:48](=[O:50])[CH2:49]1.[CH2:24]([P:25]([CH2:26][CH2:27][CH2:28][CH3:29])[CH2:30][CH2:31][CH2:32][CH3:33])[CH2:34][CH2:35][CH3:36].[CH3:19][O:20][CH2:21][CH2:22][OH:23].[CH3:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[N:1]([C:2]([N:3]1[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]1)=[O:9])=[N:10][C:11]([N:12]1[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]1)=[O:18].[OH2:67]>>[CH3:19][O:20][CH2:21][CH2:22][O:57][c:52]1[c:51]([N:47]2[CH2:46][C:45]([CH3:58])([CH3:59])[N:44]([C:42]([O:41][C:37]([CH3:38])([CH3:39])[CH3:40])=[O:43])[CH2:49][C:48]2=[O:50])[cH:56][cH:55][cH:54][cH:53]1
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반응물 6

HCID 962WaterHCID 1140TolueneHCID 80192-MethoxyethanolHCID 13831TributylphosphineHCID 730421,1'-(Azodicarbonyl)dipiperidineHCID 666456104-(2-Hydroxyphenyl)-2,2-dimethyl-5-oxopiperazine-1-carboxylic acid t-butyl ester

생성물 1

HCID 66645424
4-[2-(2-Methoxyethoxy)phenyl]-2,2-dimethyl-5-oxopiperazine-1-carboxylic acid t-butyl ester

출처 및 근거

ORD 기록
ord-e6703729e2d64999b7026cb12c7b60fc
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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