1,2-Dichloroethane → HCID 57494025, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([NH:14][CH2:15][CH2:16][O:17][CH3:18])[CH2:12][CH2:13]1.[C:30]([O:31][BH-:32]([O:33][C:34](=[O:35])[CH3:36])[O:37][C:38](=[O:39])[CH3:40])(=[O:41])[CH3:42].[CH3:26][C:27](=[O:28])[OH:29].[Cl:44][CH2:45][CH2:46][Cl:47].[Cl:48][CH2:49][Cl:50].[Na+:43].[s:19]1[c:20]([CH:24]=[O:25])[n:21][cH:22][cH:23]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([N:14]([CH2:15][CH2:16][O:17][CH3:18])[CH2:24][c:20]2[s:19][cH:23][cH:22][n:21]2)[CH2:12][CH2:13]1Participants
8
Sources & evidence
- ORD record
- ord-2679bfb36a79466e958df3fc7fd7dae6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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