Toluene → HCID 178422786, 화합물

HRID 1539035노트

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HRID 1539035 반응식
[CH3:40][Al:41]([CH3:42])[CH3:43].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[Cl:1][c:2]1[cH:3][n:4][cH:5][c:6]([Cl:27])[c:7]1[NH:8][c:9]1[nH:10][c:11]2[c:12]([n:13]1)[cH:14][c:15]([C:23]([O:25][CH3:24])=[O:26])[c:16]1[c:17]2[CH2:18][C:19]([CH3:21])([CH3:22])[O:20]1.[F:28][c:29]1[c:30]([NH2:31])[cH:32][c:33]([C:36]([F:37])([F:38])[F:39])[cH:34][cH:35]1>>[Cl:1][c:2]1[cH:3][n:4][cH:5][c:6]([Cl:27])[c:7]1[NH:8][c:9]1[nH:10][c:11]2[c:12]([n:13]1)[cH:14][c:15]([C:23](=[O:25])[NH:31][c:30]1[c:29]([F:28])[cH:35][cH:34][c:33]([C:36]([F:37])([F:38])[F:39])[cH:32]1)[c:16]1[c:17]2[CH2:18][C:19]([CH3:21])([CH3:22])[O:20]1

참가 물질

5

출처 및 근거

ORD 기록
ord-71c6cc9319974d5398509b41f17b7c2b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

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