Trifluoroacetic acid → Ethyl 1-(6-amino-3,5-difluoropyridin-2-yl)-5,6,7,8-tetrafluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate

반응식

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

참가 물질

반응물 2

HCID 6422Trifluoroacetic acid

HCID 22121224Ethyl 1-[3,5-difluoro-6-(p-methoxybenzylamino)pyridin-2-yl]-5,6,7,8-tetrafluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate

생성물 1

HCID 22121241Ethyl 1-(6-amino-3,5-difluoropyridin-2-yl)-5,6,7,8-tetrafluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate

출처 및 근거

ORD 기록: ord-442da8b37a274448a83015510a00ae51
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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