Sodium ion → 2,3,6-Trifluoro-1-ethylbenzene

HRID 670744노트

반응식

HRID 670744 반응식
[Al+3:2].[CH3:32][CH2:33][O:34][CH2:35][CH3:36].[H-:1].[H-:4].[H-:5].[H-:6].[Li+:3].[Na+:31].[OH-:30].[OH2:29].[c:7]1([CH3:8])[cH:9][cH:10][c:11]([S:12]([O:13][CH2:17][CH2:18][c:19]2[c:20]([F:27])[c:21]([F:26])[cH:22][cH:23][c:24]2[F:25])(=[O:14])=[O:15])[cH:16][cH:28]1>>[CH3:17][CH2:18][c:19]1[c:20]([F:27])[c:21]([F:26])[cH:22][cH:23][c:24]1[F:25]

참가 물질

9

출처 및 근거

ORD 기록
ord-74c9799c2ba54e7baffd5efcdba09511
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

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