Toluene → N-(2-(3,3-Difluoropyrrolidin-1-yl)-3-fluorobenzylidene)-3,3-dimethylbutan-1-amine

HRID 1123186

반응식

HRID 1123186 반응식
[CH3:17][C:18]([CH2:19][CH2:20][NH2:21])([CH3:22])[CH3:23].[CH3:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[F:1][C:2]1([F:16])[CH2:3][N:4]([c:7]2[c:8]([CH:9]=[O:10])[cH:11][cH:12][cH:13][c:14]2[F:15])[CH2:5][CH2:6]1>>[F:1][C:2]1([F:16])[CH2:3][N:4]([c:7]2[c:8]([CH:9]=[N:21][CH2:20][CH2:19][C:18]([CH3:17])([CH3:22])[CH3:23])[cH:11][cH:12][cH:13][c:14]2[F:15])[CH2:5][CH2:6]1

참가 물질

4

반응물 3

HCID 1140TolueneHCID 197093,3-DimethylbutylamineHCID 577744763-Fluoro-2-(3,3-difluoropyrrolidin-1-yl)benzaldehyde

생성물 1

HCID 57774377N-(2-(3,3-Difluoropyrrolidin-1-yl)-3-fluorobenzylidene)-3,3-dimethylbutan-1-amine

출처 및 근거

ORD 기록
ord-dcbc5766a02b4fdda29f73f27fc98d53
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

연결된 노트

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