Water → (4-Octoxyphenyl) 4-[4-(1,1,1-trifluorooctan-2-yloxycarbonyl)phenyl]benzoate
Reaction equation
[CH2:30]([CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37])[O:38][c:39]1[cH:40][cH:41][c:42]([OH:45])[cH:43][cH:44]1.[CH2:62]([Cl:63])[Cl:64].[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH3:53][N:54]([c:55]1[cH:56][cH:57][cH:58][cH:59][n:60]1)[CH3:61].[F:1][C:2]([CH:3]([CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH3:9])[O:10][C:11](=[O:12])[c:13]1[cH:14][cH:15][c:16](-[c:19]2[cH:20][cH:21][c:22]([C:25](=[O:26])[Cl:27])[cH:23][cH:24]2)[cH:17][cH:18]1)([F:28])[F:29].[OH2:65]>>[F:1][C:2]([CH:3]([CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH3:9])[O:10][C:11](=[O:12])[c:13]1[cH:14][cH:15][c:16](-[c:19]2[cH:20][cH:21][c:22]([C:25](=[O:26])[O:45][c:42]3[cH:41][cH:40][c:39]([O:38][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37])[cH:44][cH:43]3)[cH:23][cH:24]2)[cH:17][cH:18]1)([F:28])[F:29]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-0e5a494402a64e95a8d3fcba5f77d772
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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