3-Bromo-1,1,1-Trifluoro-2-Propanol → n-Butyl 6-[N-(5-bromo-2-(2-hydroxy-3,3,3-trifluoropropoxy)benzyl)-N-ethylamino]pyridazine-3-carboxylate

반응식

[Br:1][CH2:2][CH:3]([C:4]([F:5])([F:6])[F:7])[OH:8].[Br:9][c:10]1[cH:11][cH:12][c:13]([OH:33])[c:14]([CH2:15][N:16]([CH2:17][CH3:18])[c:19]2[cH:20][cH:21][c:22]([C:25](=[O:26])[O:27][CH2:28][CH2:29][CH2:30][CH3:31])[n:23][n:24]2)[cH:32]1>>[CH2:2]([CH:3]([C:4]([F:5])([F:6])[F:7])[OH:8])[O:33][c:13]1[cH:12][cH:11][c:10]([Br:9])[cH:32][c:14]1[CH2:15][N:16]([CH2:17][CH3:18])[c:19]1[cH:20][cH:21][c:22]([C:25](=[O:26])[O:27][CH2:28][CH2:29][CH2:30][CH3:31])[n:23][n:24]1

참가 물질

반응물 2

HCID 2206323-Bromo-1,1,1-Trifluoro-2-Propanol

HCID 22622486butyl 6-[N-(5-bromo-2-hydroxybenzyl)-N-ethylamino]pyridazine-3-carboxylate

생성물 1

HCID 22622518n-Butyl 6-[N-(5-bromo-2-(2-hydroxy-3,3,3-trifluoropropoxy)benzyl)-N-ethylamino]pyridazine-3-carboxylate

출처 및 근거

ORD 기록: ord-4b8b717bf42f499e81ba3e99010ea9ef
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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