1,2-Dichloroethane → HCID 18447432, compound
Reaction equation
[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[CH2:36]([c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)[N:43]1[CH:44]2[CH2:45][C:46](=[O:51])[CH2:47][CH:48]1[CH2:49][CH2:50]2.[CH3:15][C:16](=[O:17])[OH:18].[CH3:19][c:20]1[c:21]2[cH:22][n:23][n:24]([CH:30]3[O:31][CH2:32][CH2:33][CH2:34][CH2:35]3)[c:25]2[cH:26][cH:27][c:28]1[NH2:29].[Cl:57][CH2:58][CH2:59][Cl:60].[Na+:14].[Na+:52].[OH:53][C:54](=[O:55])[O-:56]>>[CH3:19][c:20]1[c:21]2[cH:22][n:23][n:24]([CH:30]3[O:31][CH2:32][CH2:33][CH2:34][CH2:35]3)[c:25]2[cH:26][cH:27][c:28]1[NH:29][CH:46]1[CH2:45][CH:44]2[N:43]([CH2:36][c:37]3[cH:38][cH:39][cH:40][cH:41][cH:42]3)[CH:48]([CH2:47]1)[CH2:49][CH2:50]2Participants
8
Sources & evidence
- ORD record
- ord-77aa3498c0eb48a3914765f413c1fb55
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…