Sodium ion → 2-[4-(4-Chlorophenoxy)-phenoxy]-propanol
Reaction equation
[BH4-:52].[CH2:21]([O:22][C:23]([Cl:24])=[O:25])[CH3:26].[CH2:55]1[O:56][CH2:57][CH2:58][CH2:59]1.[CH3:60][CH2:61][N:62]([CH2:63][CH3:64])[CH2:65][CH3:66].[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[cH:8][cH:9][c:10]([O:11][CH:12]([C:13](=[O:14])[OH:15])[CH3:16])[cH:17][cH:18]2)[cH:19][cH:20]1.[Cl:27][c:28]1[cH:29][cH:30][c:31]([O:32][c:33]2[cH:34][cH:35][c:36]([O:37][CH2:38][CH2:39][C:40](=[O:41])[O:42][C:43](=[O:44])[O:45][CH2:46][CH3:47])[cH:48][cH:49]2)[cH:50][cH:51]1.[Na+:53].[OH2:54]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[cH:8][cH:9][c:10]([O:11][CH:12]([CH2:13][OH:14])[CH3:16])[cH:17][cH:18]2)[cH:19][cH:20]1Participants
9
Sources & evidence
- ORD record
- ord-e534c71ba4674e9895f4f5b9a0d4f256
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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