Ammonium → Methyl 3-chloro-5-(hydroxymethyl)benzoate
반응식
[BH3:20].[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([C:7](=[O:8])[OH:9])[cH:10][c:11]([Cl:13])[cH:12]1)=[O:14].[Cl-:21].[NH4+:22].[O:15]1[CH2:16][CH2:17][CH2:18][CH2:19]1.[O:23]1[CH2:24][CH2:25][CH2:26][CH2:27]1>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([CH2:7][OH:8])[cH:10][c:11]([Cl:13])[cH:12]1)=[O:14]참가 물질
6
출처 및 근거
- ORD 기록
- ord-70a4e321883c4d8ca40c97720129330a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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