1,2-Dichloroethane → HCID 178456259, 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].[CH3:33][C:34]([CH3:35])=[O:36].[CH:1]([CH3:2])([CH3:3])[S:4](=[O:5])(=[O:6])[CH2:7][CH:8]1[CH2:9][NH:10][CH2:11][CH2:12][CH:13]1[N:14]1[C:15](=[O:32])[CH:16]([NH:19][C:20]([c:21]2[cH:22][c:23]([C:27]([F:28])([F:29])[F:30])[cH:24][cH:25][cH:26]2)=[O:31])[CH2:17][CH2:18]1.[Cl:51][CH2:52][CH2:53][Cl:54].[Na+:50]>>[CH:1]([CH3:2])([CH3:3])[S:4](=[O:5])(=[O:6])[CH2:7][CH:8]1[CH2:9][N:10]([CH:34]([CH3:33])[CH3:35])[CH2:11][CH2:12][CH:13]1[N:14]1[C:15](=[O:32])[CH:16]([NH:19][C:20]([c:21]2[cH:22][c:23]([C:27]([F:28])([F:29])[F:30])[cH:24][cH:25][cH:26]2)=[O:31])[CH2:17][CH2:18]1Participants
6
Sources & evidence
- ORD record
- ord-7724905328eb42d593ed32c6444fde1f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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