Methylparaben → Methyl 4-[3-(dimethylamino)propoxy]benzoate
Reaction equation
[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([OH:10])[cH:8][cH:9]1)=[O:11].[CH3:31][N:32]([CH2:33][CH2:34][CH2:35][OH:36])[CH3:37].[c:12]1([P:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([O:10][CH2:35][CH2:34][CH2:33][N:32]([CH3:31])[CH3:37])[cH:8][cH:9]1)=[O:11]Participants
5
Sources & evidence
- ORD record
- ord-492e8f85e5e745828aca6d2d49fa56f8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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