Chloride → 4H-1,3-Benzodioxin-4-one, 5-hydroxy-2,2-dimethyl-

HRID 307125Notes

Reaction equation

HRID 307125 reaction equation
[C:45]([c:46]1[cH:47][c:48]([CH3:49])[cH:50][c:51]([C:52]([CH3:53])([CH3:54])[CH3:55])[c:56]1[OH:57])([CH3:58])([CH3:59])[CH3:60].[CH3:1][C:2]1([CH3:21])[O:3][c:4]2[c:5]([c:9]([O:13][S:14]([C:15]([F:16])([F:17])[F:18])(=[O:19])=[O:20])[cH:10][cH:11][cH:12]2)[C:6](=[O:8])[O:7]1.[CH3:22][O:23][c:24]1[cH:25][cH:26][c:27]([Sn:28]([CH2:29][CH2:30][CH2:31][CH3:32])([CH2:33][CH2:34][CH2:35][CH3:36])[CH2:37][CH2:38][CH2:39][CH3:40])[cH:41][n:42]1.[Cl-:44].[Li+:43].[O:61]1[CH2:62][CH2:63][O:64][CH2:65][CH2:66]1>>[CH3:1][C:2]1([CH3:21])[O:3][c:4]2[c:5]([c:9]([OH:13])[cH:10][cH:11][cH:12]2)[C:6](=[O:8])[O:7]1

Participants

7

Reactant 6

HCID 312ChlorideHCID 28486Lithium ionHCID 312751,4-DioxaneHCID 314042,6-Di-tert-butyl-4-methylphenolHCID 108927482,2-Dimethyl-4-oxo-4H-benzo[D][1,3]dioxin-5-YL trifluoromethanesulfonateHCID 117290212-Methoxy-5-(tributylstannyl)pyridine

Product 1

HCID 110525144H-1,3-Benzodioxin-4-one, 5-hydroxy-2,2-dimethyl-

Sources & evidence

ORD record
ord-f0bcf24c740e487fb864e1f6f0509993
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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