Toluene → HCID 67483437, compound
Reaction equation
[CH3:67][c:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1.[CH:1](=[O:2])[c:3]1[n:4][c:5]([CH:40]([CH3:41])[CH3:42])[c:6]([CH2:21][O:22][Si:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[C:36]([CH3:37])([CH3:38])[CH3:39])[c:7](-[c:14]2[cH:15][cH:16][c:17]([F:20])[cH:18][cH:19]2)[c:8]1[CH2:9][CH2:10][CH2:11][CH2:12][CH3:13].[c:43]1([P:44]([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)=[CH:62][C:63](=[O:64])[O:65][CH3:66])[cH:57][cH:58][cH:59][cH:60][cH:61]1>>[c:3]1([CH:67]=[CH:62][C:63](=[O:64])[O:65][CH3:66])[n:4][c:5]([CH:40]([CH3:41])[CH3:42])[c:6]([CH2:21][O:22][Si:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[C:36]([CH3:37])([CH3:38])[CH3:39])[c:7](-[c:14]2[cH:15][cH:16][c:17]([F:20])[cH:18][cH:19]2)[c:8]1[CH2:9][CH2:10][CH2:11][CH2:12][CH3:13]Participants
4
Sources & evidence
- ORD record
- ord-bc98d11601034be2ac98a1417093552e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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