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Bicarbonate Ion → 6-Ethoxy-5-(trifluoromethyl)pyridin-2-amine

HRID 678584
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HRID 678584 반응식
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([CH2:9][c:10]2[cH:11][cH:12][c:13]([O:14][CH3:15])[cH:16][cH:17]2)[c:18]2[n:19][c:20]([O:28][CH2:29][CH3:30])[c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]2)[cH:31][cH:32]1.[CH3:45][CH2:46][O:47][C:48]([CH3:49])=[O:50].[F:33][C:34]([F:35])([F:36])[C:37]([OH:38])=[O:39].[Na+:44].[O-:40][C:41]([OH:42])=[O:43]>>[NH2:8][c:18]1[n:19][c:20]([O:28][CH2:29][CH3:30])[c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]1
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참가 물질

6

반응물 5

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 67190754N,N-Bis-(4-methoxybenzyl)-(6-ethoxy-5-trifluoromethylpyridine-2-yl)amine

생성물 1

HCID 574468476-Ethoxy-5-(trifluoromethyl)pyridin-2-amine

출처 및 근거

ORD 기록
ord-bde093db8dc546b3bea501ce6b9500ff
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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