1,3-Dichloro-2-isocyanatobenzene → HCID 57710276, 화합물
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[CH2:1]([CH3:2])[N:3]([c:4]1[cH:5][cH:6][c:7]([NH:10][c:11]2[n:12][cH:13][n:14][c:15]([NH:17][CH3:18])[cH:16]2)[cH:8][cH:9]1)[CH2:19][CH3:20].[Cl:21][c:22]1[c:23]([N:29]=[C:30]=[O:31])[c:24]([Cl:28])[cH:25][cH:26][cH:27]1>>[CH2:1]([CH3:2])[N:3]([c:4]1[cH:5][cH:6][c:7]([NH:10][c:11]2[n:12][cH:13][n:14][c:15]([N:17]([CH3:18])[C:30]([NH:29][c:23]3[c:22]([Cl:21])[cH:27][cH:26][cH:25][c:24]3[Cl:28])=[O:31])[cH:16]2)[cH:8][cH:9]1)[CH2:19][CH3:20]참가 물질
3
출처 및 근거
- ORD 기록
- ord-621cf1e95d7248b38c559eb56f794b92
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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