1,2-Dichloroethane → HCID 10136355, compound
Reaction equation
[C:37]([O:38][BH-:39]([O:40][C:41](=[O:42])[CH3:43])[O:44][C:45](=[O:46])[CH3:47])(=[O:48])[CH3:49].[CH3:17][N:18]([C:19]1([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH2:20][CH2:21][C:22](=[O:25])[CH2:23][CH2:24]1)[CH3:32].[CH3:33][C:34](=[O:35])[OH:36].[Cl:51][CH2:52][CH2:53][Cl:54].[NH2:1][c:2]1[cH:3][cH:4][c:5]2[n:6]([CH2:15][CH3:16])[c:7]3[cH:8][cH:9][cH:10][cH:11][c:12]3[c:13]2[cH:14]1.[Na+:50]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]2[n:6]([CH2:15][CH3:16])[c:7]3[cH:8][cH:9][cH:10][cH:11][c:12]3[c:13]2[cH:14]1)[CH:22]1[CH2:21][CH2:20][C:19]([N:18]([CH3:17])[CH3:32])([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH2:24][CH2:23]1Participants
7
Sources & evidence
- ORD record
- ord-d94d2f53d5a84899910e048c87f2d67a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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