1,2-Dichloroethane → HCID 14324463, compound
Reaction equation
[Cl-:37].[Cl-:39].[Cl:27][CH2:28][CH2:29][Cl:30].[ClH:36].[OH2:40].[S:31](=[O:32])(=[O:33])([OH:34])[OH:35].[Zn+2:38].[c:1]1(-[c:7]2[cH:8][c:9](=[O:26])[n:10](-[c:12]3[c:13]([N+:23](=[O:24])[O-:25])[cH:14][c:15]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[cH:16][cH:17]3)[o:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[c:8]([CH2:28][Cl:27])[c:9](=[O:26])[n:10](-[c:12]3[c:13]([N+:23](=[O:24])[O-:25])[cH:14][c:15]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[cH:16][cH:17]3)[o:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
8
Sources & evidence
- ORD record
- ord-e793bcae90de4d688e3c294a8f996e2f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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