Water → 3,4-Difluorobenzoic acid-trans-4-pentylcyclohexyl ester
반응식
[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[CH:6]1[CH2:7][CH2:8][CH:9]([OH:12])[CH2:10][CH2:11]1.[CH3:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[F:13][c:14]1[cH:15][c:16]([C:17](=[O:18])[Cl:19])[cH:20][cH:21][c:22]1[F:23].[OH2:37].[cH:24]1[cH:25][cH:26][n:27][cH:28][cH:29]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[CH:6]1[CH2:7][CH2:8][CH:9]([O:12][C:17]([c:16]2[cH:15][c:14]([F:13])[c:22]([F:23])[cH:21][cH:20]2)=[O:18])[CH2:10][CH2:11]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-74fd5e77b7a741b29c99649c7d96e1ca
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
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