Acetone → 3-(Octadecyloxy)-5-(3-phenoxypropoxy)benzoic acid phenylmethyl ester
Reaction equation
[C:50](=[O:51])([O-:52])[O-:53].[CH3:56][C:57](=[O:58])[CH3:59].[I-:49].[K+:54].[K+:55].[Na+:48].[O:37]([c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1)[CH2:44][CH2:45][CH2:46][Br:47].[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[c:1]1([CH2:7][O:8][C:9]([c:10]2[cH:11][c:12]([OH:35])[cH:13][c:14]([O:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34])[cH:15]2)=[O:36])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][O:8][C:9]([c:10]2[cH:11][c:12]([O:35][CH2:46][CH2:45][CH2:44][O:37][c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[cH:13][c:14]([O:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34])[cH:15]2)=[O:36])[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-346d53540ee64fdca7c13857cb7219e4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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