Acetone → 6-[3-(Chloromethylene)-2,3-dihydro-1-benzoxepin-7-yl]-5-hexen-2-one
Reaction equation
[CH3:24][C:25](=[O:26])[CH3:27].[Cl:1][CH:2]=[C:3]1[CH2:4][O:5][c:6]2[c:7]([cH:10][c:11]([CH:14]=[CH:15][CH2:16][CH2:17][C:18]3([CH3:23])[O:19][CH2:22][CH2:21][O:20]3)[cH:12][cH:13]2)[CH:8]=[CH:9]1.[Cl:39][CH2:40][Cl:41].[c:28]1([CH3:29])[cH:30][cH:31][c:32]([S:33]([OH:34])(=[O:35])=[O:36])[cH:37][cH:38]1>>[Cl:1][CH:2]=[C:3]1[CH2:4][O:5][c:6]2[c:7]([cH:10][c:11]([CH:14]=[CH:15][CH2:16][CH2:17][C:18](=[O:19])[CH3:23])[cH:12][cH:13]2)[CH:8]=[CH:9]1Participants
5
Sources & evidence
- ORD record
- ord-35c9b1bca7fc480da29cf6c38e8adfdc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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