Toluene → HCID 68837806, compound
Reaction equation
[C:28]([CH3:29])([CH3:30])([CH3:31])[O:32][C:33]([CH:34]=[P:35]([c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)([c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)[c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)=[O:54].[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:18]2[cH:19][c:20]([CH:26]=[O:27])[c:21]([O:24][CH3:25])[cH:22][cH:23]2)[c:8]([Br:17])[c:9]1[O:10][CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16].[CH3:55][c:56]1[cH:57][cH:58][cH:59][cH:60][cH:61]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:18]2[cH:19][c:20]([CH:55]=[CH:34][C:33]([O:32][C:28]([CH3:29])([CH3:30])[CH3:31])=[O:54])[c:21]([O:24][CH3:25])[cH:22][cH:23]2)[c:8]([Br:17])[c:9]1[O:10][CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16]Participants
4
Sources & evidence
- ORD record
- ord-2bed8e0faf1c411b8b539bf79fa7f8c8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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