Ethanol → 4-Hydroxymethyl-2-(2-methylphenyl)benzoic acid
반응식
[CH3:1][O:2][C:3]([c:4]1[c:5](-[c:12]2[c:13]([CH3:18])[cH:14][cH:15][cH:16][cH:17]2)[cH:6][c:7]([CH2:10][OH:11])[cH:8][cH:9]1)=[O:19].[CH3:22][CH2:23][OH:24].[Na+:21].[OH-:20]>>[O:2]=[C:3]([c:4]1[c:5](-[c:12]2[c:13]([CH3:18])[cH:14][cH:15][cH:16][cH:17]2)[cH:6][c:7]([CH2:10][OH:11])[cH:8][cH:9]1)[OH:19]참가 물질
5
출처 및 근거
- ORD 기록
- ord-d1bd41a6f7cb4c9ca08b9c41321f46e1
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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