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Methanol → 2-{4-[2-(4-Methyl-piperidin-1-yl)-ethoxy]-phenylethynyl}-5-phenyl-pyridine

HRID 301956
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HRID 301956 반응식
[Br:11][c:12]1[cH:13][cH:14][c:15]([C:18]#[C:19][c:20]2[cH:21][cH:22][c:23]([O:26][CH2:27][CH2:28][N:29]3[CH2:30][CH2:31][CH:32]([CH3:35])[CH2:33][CH2:34]3)[cH:24][cH:25]2)[n:16][cH:17]1.[C:36](=[O:37])([O-:38])[O-:39].[CH2:42]1[O:43][CH2:44][CH2:45][O:46][CH2:47]1.[CH3:48][OH:49].[CH3:50][CH2:51][O:52][C:53]([CH3:54])=[O:55].[Na+:40].[Na+:41].[c:1]1([O:7][B:8]([OH:9])[OH:10])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:12]2[cH:13][cH:14][c:15]([C:18]#[C:19][c:20]3[cH:21][cH:22][c:23]([O:26][CH2:27][CH2:28][N:29]4[CH2:30][CH2:31][CH:32]([CH3:35])[CH2:33][CH2:34]4)[cH:24][cH:25]3)[n:16][cH:17]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1
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참가 물질

8

반응물 7

HCID 887MethanolHCID 923Sodium Ion2회HCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 78412Phenyl dihydrogen orthoborateHCID 690601725-Bromo-2-{4-[2-(4-methylpiperidin-1-yl)ethoxy]phenylethynyl}pyridine

생성물

1
HCID 598357442-{4-[2-(4-Methyl-piperidin-1-yl)-ethoxy]-phenylethynyl}-5-phenyl-pyridine

출처 및 근거

ORD 기록
ord-ea6e5fc338714b848f866efc8937e540
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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