1,2-Dichloroethane → HCID 59404973, compound
Reaction equation
[C:39]([O:40][BH-:41]([O:42][C:43](=[O:44])[CH3:45])[O:46][C:47](=[O:48])[CH3:49])(=[O:50])[CH3:51].[Cl:53][CH2:54][CH2:55][Cl:56].[F:33][C:34]([CH2:35][NH2:36])([F:37])[F:38].[NH2:1][c:2]1[n:3][cH:4][n:5][n:6]2[c:7]1[c:8](-[c:13]1[cH:14][cH:15][c:16]([NH:19][C:20](=[O:21])[NH:22][c:23]3[n:24][c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][cH:27][cH:28]3)[cH:17][cH:18]1)[cH:9][c:10]2[CH:11]=[O:12].[Na+:52]>>[NH2:1][c:2]1[n:3][cH:4][n:5][n:6]2[c:7]1[c:8](-[c:13]1[cH:14][cH:15][c:16]([NH:19][C:20](=[O:21])[NH:22][c:23]3[n:24][c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][cH:27][cH:28]3)[cH:17][cH:18]1)[cH:9][c:10]2[CH2:11][NH:36][CH2:35][C:34]([F:33])([F:37])[F:38]Participants
6
Sources & evidence
- ORD record
- ord-e745d7de7eed469ca207b82a2bcb28d0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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