Benzene → Bromide ion
반응식
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[NH:9][c:10]1[cH:11][cH:12][c:13]([O:16][C:17]([CH2:18][CH2:19][CH2:20][CH2:21][Br:22])=[O:23])[cH:14][cH:15]1.[c:24]1([P:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:25][cH:26][cH:27][cH:28][cH:29]1.[cH:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[Br-:22].[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[NH:9][c:10]1[cH:11][cH:12][c:13]([O:16][C:17]([CH2:18][CH2:19][CH2:20][CH2:21][P+:30]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)=[O:23])[cH:14][cH:15]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-56a570738e324241b94fbebd0648898d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)