Water → Benzoic acid, 2,3,4,5-tetrachloro-6-cyano-, methyl ester
반응식
[CH2:17]([C:18]([CH3:19])=[O:20])[CH3:21].[CH3:22][I:23].[Cl:2][c:3]1[c:4]([C:15]#[N:16])[c:5]([C:6](=[O:7])[OH:8])[c:9]([Cl:14])[c:10]([Cl:13])[c:11]1[Cl:12].[K:1].[OH2:24]>>[Cl:2][c:3]1[c:4]([C:15]#[N:16])[c:5]([C:6](=[O:7])[O:8][CH3:17])[c:9]([Cl:14])[c:10]([Cl:13])[c:11]1[Cl:12]참가 물질
6
출처 및 근거
- ORD 기록
- ord-d7d96af71c9e4eb88ddf7c5159a5fd83
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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