Ethanol → Ethyl 2-(2-bromo-4,5-difluorobenzoyl)-3-(2-thienyl)acrylate

반응식

[Br:1][c:2]1[c:3]([C:4](=[O:5])[C:6]([C:7](=[O:8])[O:9][CH2:10][CH3:11])=[CH:12][O:13][CH2:14][CH3:15])[cH:16][c:17]([F:21])[c:18]([F:20])[cH:19]1.[CH3:28][CH2:29][OH:30].[NH2:22][c:23]1[s:24][cH:25][cH:26][cH:27]1>>[Br:1][c:2]1[c:3]([C:4](=[O:5])[C:6]([C:7](=[O:8])[O:9][CH2:10][CH3:11])=[CH:12][c:23]2[s:24][cH:25][cH:26][cH:27]2)[cH:16][c:17]([F:21])[c:18]([F:20])[cH:19]1

참가 물질

반응물 3

HCID 702Ethanol

HCID 973732-Aminothiophene

HCID 54231265Ethyl 2-(2-bromo-4,5-difluorobenzoyl)-3-ethoxyacrylate

생성물 1

HCID 54013434Ethyl 2-(2-bromo-4,5-difluorobenzoyl)-3-(2-thienyl)acrylate

출처 및 근거

ORD 기록: ord-92b2300295f24fe58935ebc88d4b1597
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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