3-Bromobenzonitrile → 2-[2-(3-Cyanophenyl)-4-(trifluoromethyl)phenoxy]propanoic acid
반응식
[B:1]([OH:2])([OH:3])[c:4]1[c:5]([O:6][CH:7]([C:8](=[O:9])[OH:10])[CH3:11])[cH:12][cH:13][c:14]([C:16]([F:17])([F:18])[F:19])[cH:15]1.[Br:20][c:21]1[cH:22][c:23]([C:24]#[N:25])[cH:26][cH:27][cH:28]1>>[c:4]1(-[c:21]2[cH:22][c:23]([C:24]#[N:25])[cH:26][cH:27][cH:28]2)[c:5]([O:6][CH:7]([C:8](=[O:9])[OH:10])[CH3:11])[cH:12][cH:13][c:14]([C:16]([F:17])([F:18])[F:19])[cH:15]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-8ef3681a4b144f2fb2b6a72bae6679ac
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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