Bromide ion → Benzoic acid, 4-hexyl-, methyl ester
Reaction equation
[Br-:31].[CH2:19]1[O:20][CH2:21][CH2:22][CH2:23]1.[CH2:32]([CH2:33][CH2:34][CH2:35][CH2:36][CH3:37])[Mg+:38].[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([O:10][S:11]([C:12]([F:13])([F:14])[F:15])(=[O:16])=[O:17])[cH:8][cH:9]1)=[O:18].[CH3:24][N:25]1[CH2:26][CH2:27][CH2:28][C:29]1=[O:30].[CH3:39][CH2:40][O:41][CH2:42][CH3:43]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37])[cH:8][cH:9]1)=[O:18]Participants
7
Sources & evidence
- ORD record
- ord-1ea10f7d7c5a46b394e302d9692424e8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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