Toluene → Bromide ion
반응식
[Br:1][CH2:2][C:3]1=[CH:9][c:8]2[c:7]([cH:13][cH:12][c:11](-[c:14]3[cH:15][cH:16][c:17]([CH3:20])[cH:18][cH:19]3)[cH:10]2)[O:6][CH2:5][CH2:4]1.[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[c:21]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[Br-:1].[CH2:2]([C:3]1=[CH:9][c:8]2[c:7]([cH:13][cH:12][c:11](-[c:14]3[cH:15][cH:16][c:17]([CH3:20])[cH:18][cH:19]3)[cH:10]2)[O:6][CH2:5][CH2:4]1)[P+:27]([c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-92c9d822ca974b7f89b92fc062d00e1d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)