Hydrochloric Acid → 4-Methyl-2,3,5,6-tetrafluorobenzonitrile
반응식
[CH2:21]([Cl:22])[Cl:23].[ClH:20].[F:6][c:7]1[c:8]([CH3:19])[c:9]([F:18])[c:10]([F:17])[c:11]([C:14](=[O:15])[NH2:16])[c:12]1[F:13].[P:1]([Cl:2])([Cl:3])([Cl:4])=[O:5].[cH:24]1[cH:25][cH:26][n:27][cH:28][cH:29]1>>[F:6][c:7]1[c:8]([CH3:19])[c:9]([F:18])[c:10]([F:17])[c:11]([C:14]#[N:16])[c:12]1[F:13]참가 물질
6
출처 및 근거
- ORD 기록
- ord-e96936a18c704e2196c36d758046380b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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