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Toluene → 3-(2-Chloro-6-fluorophenyl)-5-[2-(dimethylamino)ethenyl]-1,2-oxazole-4-carbonitrile

HRID 1204091
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HRID 1204091 반응식
[C:17]([O:18][CH:22]([N:19]([CH3:20])[CH3:21])[N:23]([CH3:24])[CH3:25])([CH3:26])([CH3:27])[CH3:28].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[Cl:1][c:2]1[c:3](-[c:9]2[n:10][o:11][c:12]([CH3:16])[c:13]2[C:14]#[N:15])[c:4]([F:8])[cH:5][cH:6][cH:7]1.[Cl:29][C:30]([Cl:31])([Cl:32])[Cl:33]>>[Cl:1][c:2]1[c:3](-[c:9]2[n:10][o:11][c:12]([CH:16]=[CH:22][N:23]([CH3:24])[CH3:25])[c:13]2[C:14]#[N:15])[c:4]([F:8])[cH:5][cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 1140TolueneHCID 5943Carbon TetrachlorideHCID 79885tert-Butoxy bis(dimethylamino)methaneHCID 27365803-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carbonitrile

생성물 1

HCID 14731783-(2-Chloro-6-fluorophenyl)-5-[2-(dimethylamino)ethenyl]-1,2-oxazole-4-carbonitrile

출처 및 근거

ORD 기록
ord-a64d92beaeb142c9a3ee62bee7cbcc30
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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