Toluene → HCID 67058134, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][CH:4]([CH2:5][C:6](=[O:7])[O:8][CH2:9][CH3:10])[c:11]1[cH:12][cH:13][c:14]([OH:17])[cH:15][cH:16]1.[F:18][C:19]([O:20][c:21]1[cH:22][c:23]([CH2:24][OH:25])[cH:26][cH:27][cH:28]1)([F:29])[F:30].[N:57]([C:58]([O:59][CH2:60][CH3:61])=[O:62])=[N:63][C:64]([O:65][CH2:66][CH3:67])=[O:68].[O:69]1[CH2:70][CH2:71][CH2:72][CH2:73]1.[c:31]1([P:32]([c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[cH:45][cH:46][cH:47][cH:48][cH:49]1.[c:50]1([CH3:51])[cH:52][cH:53][cH:54][cH:55][cH:56]1>>[CH2:1]([CH3:2])[O:3][CH:4]([CH2:5][C:6](=[O:7])[O:8][CH2:9][CH3:10])[c:11]1[cH:12][cH:13][c:14]([O:17][CH2:24][c:23]2[cH:22][c:21]([O:20][C:19]([F:18])([F:29])[F:30])[cH:28][cH:27][cH:26]2)[cH:15][cH:16]1Participants
7
Sources & evidence
- ORD record
- ord-52fab6d6923f48cea3cfb97cfeeeb394
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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