Ethylene Glycol → 3-Bromo-4-(2-hydroxyethoxy)-5-iodobenzoic acid ethyl ester
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][c:7]([Br:13])[c:8]([OH:12])[c:9]([I:11])[cH:10]1)=[O:14].[CH2:52]1[O:53][CH2:54][CH2:55][CH2:56]1.[O:38]=[C:39]([O:40][CH:41]([CH3:42])[CH3:43])[N:44]=[N:45][C:46]([O:47][CH:48]([CH3:49])[CH3:50])=[O:51].[OH:15][CH2:16][CH2:17][OH:18].[c:19]1([P:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][c:7]([Br:13])[c:8]([O:12][CH2:17][CH2:16][OH:15])[c:9]([I:11])[cH:10]1)=[O:14]Participants
6
Sources & evidence
- ORD record
- ord-50692a72af304cf3b5dd1a8db50d1d13
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…