Chloride → 8-Acetyl-6-bromo-2,2,4,4-tetramethyl chroman
반응식
[Al+3:2].[Br:9][c:10]1[cH:11][c:12]2[c:17]([cH:18][cH:19]1)[O:16][C:15]([CH3:20])([CH3:21])[CH2:14][C:13]2([CH3:22])[CH3:23].[CH3:5][C:6]([Cl:7])=[O:8].[Cl-:1].[Cl-:3].[Cl-:4].[Cl:25][CH2:26][Cl:27].[ClH:24]>>[CH3:5][C:6](=[O:8])[c:18]1[c:17]2[c:12]([cH:11][c:10]([Br:9])[cH:19]1)[C:13]([CH3:22])([CH3:23])[CH2:14][C:15]([CH3:20])([CH3:21])[O:16]2참가 물질
7
출처 및 근거
- ORD 기록
- ord-67cae008a3974cb5814b97408ae8bede
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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