2-Fluoro-4-formylbenzonitrile → 2-(4-Cyano-3-fluorophenyl)-5-(trans-4-n-propylcyclohexyl)-1,3-dioxane
반응식
[C:1](#[N:2])[c:3]1[c:4]([F:11])[cH:5][c:6]([CH:7]=[O:8])[cH:9][cH:10]1.[CH2:12]([CH2:13][CH3:14])[CH:15]1[CH2:16][CH2:17][CH:18]([CH:21]([CH2:22][OH:23])[CH2:24][OH:25])[CH2:19][CH2:20]1>>[C:1](#[N:2])[c:3]1[c:4]([F:11])[cH:5][c:6]([CH:7]2[O:8][CH2:24][CH:21]([CH:18]3[CH2:17][CH2:16][CH:15]([CH2:12][CH2:13][CH3:14])[CH2:20][CH2:19]3)[CH2:22][O:23]2)[cH:9][cH:10]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-d1686e4da41b44af82a2d249e7155eaf
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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