Chloride → 5-Cyclohexylidene-2,2-dimethyl-1,3-dioxane-4,6-dione
Reaction equation
[CH2:24]1[O:25][CH2:26][CH2:27][CH2:28]1.[CH3:1][C:2]1([CH3:10])[O:3][C:4](=[O:9])[CH2:5][C:6](=[O:8])[O:7]1.[Cl-:29].[Cl-:30].[Cl-:31].[Cl-:32].[O:11]=[C:12]1[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]1.[Ti+4:33].[cH:18]1[cH:19][cH:20][n:21][cH:22][cH:23]1>>[CH3:1][C:2]1([CH3:10])[O:3][C:4](=[O:9])[C:5](=[C:12]2[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]2)[C:6](=[O:8])[O:7]1Participants
7
Sources & evidence
- ORD record
- ord-74e3c5c248004e688b1c9a47f00d725e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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