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Diethyl Ether → Methyl 2-[4-[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]phenoxy]isobutyrate

HRID 1139110
노트
인쇄 미리보기

반응식

HRID 1139110 반응식
[Br:1][CH2:2][C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:9][C:10]([C:11](=[O:12])[O:13][CH3:14])([CH3:15])[CH3:16])[cH:17][cH:18]1.[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[CH3:38][CH2:39][O:40][CH2:41][CH3:42].[CH3:43][C:44]#[N:45].[n:19]1[cH:20][cH:21][c:22]([N:25]2[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]2)[cH:23][cH:24]1>>[CH2:2]([C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([O:9][C:10]([C:11](=[O:12])[O:13][CH3:14])([CH3:15])[CH3:16])[cH:17][cH:18]1)[N:28]1[CH2:27][CH2:26][N:25]([c:22]2[cH:21][cH:20][n:19][cH:24][cH:23]2)[CH2:30][CH2:29]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 3283Diethyl EtherHCID 6342AcetonitrileHCID 8471TriethylamineHCID 705171-(4-Pyridyl)piperazineHCID 18918561Methyl 2-(4-bromoacetylphenoxy)isobutyrate

생성물 1

HCID 18918633Methyl 2-[4-[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]phenoxy]isobutyrate

출처 및 근거

ORD 기록
ord-e548d561ebf04d409c726dd481e9fdf9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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