Benzene → (4-Bromo-3-methylphenyl)-phenylmethanone

HRID 174616

반응식

HRID 174616 반응식
[Al+3:25].[Br:1][c:2]1[c:3]([CH3:11])[cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[Cl-:22].[Cl-:23].[Cl-:24].[ClH:26].[O:27]=[CH:28][N:29]([CH3:30])[CH3:31].[S:12]([Cl:13])([Cl:14])=[O:15].[cH:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1>>[Br:1][c:2]1[c:3]([CH3:11])[cH:4][c:5]([C:6](=[O:8])[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:9][cH:10]1

참가 물질

8

출처 및 근거

ORD 기록
ord-2bd098f0d3b34392a7b2e9de45c08730
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

불러오는 중…