Benzoate → 3-Fluoro-4-(1,1,1-trifluoro-2-octyloxycarbonyl)phenyl 4-octyloxybiphenyl-4'-carboxylate
Reaction equation
[CH2:42]([CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH3:49])[O:50][c:51]1[cH:52][cH:53][c:54](-[c:57]2[cH:58][cH:59][c:60]([C:63](=[O:64])[OH:65])[cH:61][cH:62]2)[cH:55][cH:56]1.[CH2:66]([Cl:67])[Cl:68].[CH3:32][N:33]([c:34]1[cH:35][cH:36][cH:37][cH:38][n:39]1)[CH3:40].[CH3:70][CH2:71][N:72]([CH2:73][CH3:74])[CH2:75][CH3:76].[Cl-:41].[F:10][c:11]1[c:12]([C:13](=[O:14])[O:15][CH:16]([C:17]([F:18])([F:19])[F:20])[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH3:26])[cH:27][cH:28][c:29]([OH:31])[cH:30]1.[O-:1][C:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)=[O:9].[OH2:69]>>[F:10][c:11]1[c:12]([C:13](=[O:14])[O:15][CH:16]([C:17]([F:18])([F:19])[F:20])[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH3:26])[cH:27][cH:28][c:29]([O:31][C:63]([c:60]2[cH:59][cH:58][c:57](-[c:54]3[cH:53][cH:52][c:51]([O:50][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH3:49])[cH:56][cH:55]3)[cH:62][cH:61]2)=[O:64])[cH:30]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-bef41ae26458458c9da708cd6e77b53e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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