Carbon Tetrachloride → 2-[2-[2-(Bromomethyl)phenyl]-2-methylpropyl]-2-(trifluoromethyl)oxirane
반응식
[Br:19][N:20]1[C:21](=[O:22])[CH2:23][CH2:24][C:25]1=[O:26].[CH3:1][c:2]1[c:3]([C:8]([CH2:9][C:10]2([C:13]([F:14])([F:15])[F:16])[O:11][CH2:12]2)([CH3:17])[CH3:18])[cH:4][cH:5][cH:6][cH:7]1.[Cl:27][C:28]([Cl:29])([Cl:30])[Cl:31]>>[CH2:1]([c:2]1[c:3]([C:8]([CH2:9][C:10]2([C:13]([F:14])([F:15])[F:16])[O:11][CH2:12]2)([CH3:17])[CH3:18])[cH:4][cH:5][cH:6][cH:7]1)[Br:19]참가 물질
4
출처 및 근거
- ORD 기록
- ord-48c6113499a14508bef4a7312bb0dea0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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