2-Fluorobenzoyl chloride → 3-Chloro-6-(o-fluorobenzoyl)-5,6,7,8-tetrahydro-4-methylpyrido[4,3-c]pyridazine

반응식

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

참가 물질

반응물 3

HCID 98082-Fluorobenzoyl chloride

HCID 164547Butenedioate

HCID 234646843-Chloro-4-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazine

생성물 1

HCID 234646633-Chloro-6-(o-fluorobenzoyl)-5,6,7,8-tetrahydro-4-methylpyrido[4,3-c]pyridazine

출처 및 근거

ORD 기록: ord-45cb2553dcc743728eb519d6608b4431
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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