1,2-Dichloroethane → HCID 9924406, compound
Reaction equation
[C:32]([O:33][BH-:34]([O:35][C:36](=[O:37])[CH3:38])[O:39][C:40](=[O:41])[CH3:42])(=[O:43])[CH3:44].[CH3:12][N:13]([C:14]1([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[CH2:15][CH2:16][C:17](=[O:20])[CH2:18][CH2:19]1)[CH3:27].[CH3:28][C:29](=[O:30])[OH:31].[Cl:51][CH2:52][CH2:53][Cl:54].[Na+:45].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[nH:1]1[cH:2][c:3]([CH2:10][NH2:11])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12>>[nH:1]1[cH:2][c:3]([CH2:10][NH:11][CH:17]2[CH2:16][CH2:15][C:14]([N:13]([CH3:12])[CH3:27])([c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[CH2:19][CH2:18]2)[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12Participants
8
Sources & evidence
- ORD record
- ord-7c9cf8cadf4e491b80df4763b7d94afd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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