Toluene → HCID 178471047, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][CH2:8][OH:9])([CH3:10])[CH3:11].[CH2:12]([CH3:13])[O:14][C:15]([CH:16]([CH2:17][c:18]1[cH:19][cH:20][c:21]([O:24][CH2:25][CH2:26][CH2:27][O:28][c:29]2[cH:30][cH:31][c:32]([C:35]([c:36]3[cH:37][cH:38][c:39]([OH:42])[cH:40][cH:41]3)=[O:43])[cH:33][cH:34]2)[cH:22][cH:23]1)[O:44][CH3:45])=[O:46].[CH3:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1.[c:47]1([P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][CH2:8][O:9][c:39]1[cH:38][cH:37][c:36]([C:35]([c:32]2[cH:31][cH:30][c:29]([O:28][CH2:27][CH2:26][CH2:25][O:24][c:21]3[cH:20][cH:19][c:18]([CH2:17][CH:16]([C:15]([O:14][CH2:12][CH3:13])=[O:46])[O:44][CH3:45])[cH:23][cH:22]3)[cH:34][cH:33]2)=[O:43])[cH:41][cH:40]1)([CH3:10])[CH3:11]Participants
5
Sources & evidence
- ORD record
- ord-e4ae3b194ca04f01ac98e76924e0c31a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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