Acetic Acid → 2-{4-[(2,4-Dichlorobenzyl)amino]phenyl}-1,1,1,3,3,3-hexafluoropropan-2-ol

HRID 301911

반응식

HRID 301911 반응식
[C:32]([BH3-:33])#[N:34].[CH3:28][C:29](=[O:30])[OH:31].[CH3:36][OH:37].[Cl:18][c:19]1[c:20]([CH:21]=[O:22])[cH:23][cH:24][c:25]([Cl:27])[cH:26]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([C:8]([C:9]([F:10])([F:11])[F:12])([C:13]([F:14])([F:15])[F:16])[OH:17])[cH:6][cH:7]1.[Na+:35]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([C:8]([C:9]([F:10])([F:11])[F:12])([C:13]([F:14])([F:15])[F:16])[OH:17])[cH:6][cH:7]1)[CH2:21][c:20]1[c:19]([Cl:18])[cH:26][c:25]([Cl:27])[cH:24][cH:23]1

참가 물질

7

출처 및 근거

ORD 기록
ord-b6dea31b107d4750a8bb078ca80320ab
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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