1-Fluoro-2-iodobenzene → 1-(5-(2-Fluorophenyl)oxazol-2-yl)-7-phenylheptan-1-one
반응식
[C:1]([Si:2]([CH3:3])([CH3:4])[O:6][CH:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[c:20]1[o:21][c:22](-[c:25]2[c:26]([F:31])[cH:27][cH:28][cH:29][cH:30]2)[cH:23][n:24]1)([CH3:5])([CH3:32])[CH3:33].[C:34]([Si:35]([CH3:36])([CH3:37])[O:38][CH:39]([c:40]1[o:41][c:42]([Sn:43]([CH2:44][CH2:45][CH2:46][CH3:47])([CH2:48][CH2:49][CH2:50][CH3:51])[CH2:52][CH2:53][CH2:54][CH3:55])[cH:56][n:57]1)[CH2:58][CH2:59][CH2:60][CH2:61][CH2:62][CH2:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1)([CH3:70])([CH3:71])[CH3:72].[F:73][c:74]1[cH:75][cH:76][cH:77][cH:78][c:79]1[I:80]>>[O:6]=[C:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[c:20]1[o:21][c:22](-[c:25]2[c:26]([F:31])[cH:27][cH:28][cH:29][cH:30]2)[cH:23][n:24]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-9a9738b59e7b450a953021760bbc734d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
- DOI