Bromide ion → 5-(2-(3-Methoxyphenyl)propan-2-yl)-2,2-dimethyl-1,3-dioxane-4,6-dione

HRID 2142634Notes

Reaction equation

HRID 2142634 reaction equation
[Br-:29].[CH3:1][c:2]1[cH:3][c:4]([CH2:5][O:6][c:7]2[cH:8][c:9]([CH2:10][CH2:11][C:12]([OH:13])=[O:14])[cH:15][cH:16][cH:17]2)[cH:18][cH:19][c:20]1-[c:21]1[cH:22][cH:23][cH:24][c:25]([O:26][CH3:27])[cH:28]1.[CH3:30][O:31][c:32]1[cH:33][c:34]([Mg+:38])[cH:35][cH:36][cH:37]1.[CH3:39][C:40]1([CH3:51])[O:41][C:42](=[O:50])[C:43](=[C:47]([CH3:48])[CH3:49])[C:44](=[O:46])[O:45]1>>[CH3:30][O:31][c:32]1[cH:33][c:34]([C:47]([CH:43]2[C:42](=[O:50])[O:41][C:40]([CH3:39])([CH3:51])[O:45][C:44]2=[O:46])([CH3:48])[CH3:49])[cH:35][cH:36][cH:37]1

Participants

5

Reactant 4

HCID 259Bromide ionHCID 752182,2-Dimethyl-5-(1-methylethylidene)-1,3-dioxane-4,6-dioneHCID 252612983-(3-(((2-Methyl-3'-(methyloxy)-1,1'-biphenyl-4-yl)methyl)oxy)phenyl)propanoic acidHCID 178490747HCID 178490747, compound

Product 1

HCID 577072545-(2-(3-Methoxyphenyl)propan-2-yl)-2,2-dimethyl-1,3-dioxane-4,6-dione

Sources & evidence

ORD record
ord-174606bb488f416d9e74846a3a28375e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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