Acetic Acid → methyl 3-oxo-3,4-dihydro-2H-1,5-benzodioxepin-2-carboxylate
Reaction equation
[CH3:26][C:27](=[O:28])[OH:29].[CH3:3][C:4]([OH:5])([CH3:6])[CH3:7].[CH3:8][O:9][C:10](=[O:11])[CH2:12][O:13][c:14]1[c:15]([O:16][CH2:17][C:18](=[O:19])[O:20][CH3:21])[cH:22][cH:23][cH:24][cH:25]1.[H-:1].[Na+:2].[c:30]1([CH3:31])[c:32]([CH3:33])[cH:34][cH:35][cH:36][cH:37]1>>[CH3:8][O:9][C:10](=[O:11])[CH:12]1[O:13][c:14]2[c:15]([cH:22][cH:23][cH:24][cH:25]2)[O:16][CH2:17][C:18]1=[O:19]Participants
7
Sources & evidence
- ORD record
- ord-3c1cb5b140154f79a6454a94a4b9e742
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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