Potassium Cation → 3-(1,3-Benzodioxol-5-yl)-6-propoxy-1H-inden-1-one

HRID 1239729Notes

Reaction equation

HRID 1239729 reaction equation
[K+:20].[K+:21].[O-:22][C:23]([O-:24])=[O:25].[O:26]1[CH2:27][O:28][c:29]2[c:30]1[cH:31][cH:32][c:33]([CH:35]=[CH:36][C:37](=[O:38])[c:39]1[c:40]([Br:49])[cH:41][cH:42][c:43]([O:45][CH2:46][CH2:47][CH3:48])[cH:44]1)[cH:34]2.[O:53]=[CH:54][N:55]([CH3:56])[CH3:57].[Pd:50]([Cl:51])[Cl:52].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[O:26]1[CH2:27][O:28][c:29]2[c:30]1[cH:31][cH:32][c:33]([C:35]1=[CH:36][C:37](=[O:38])[c:39]3[c:40]1[cH:41][cH:42][c:43]([O:45][CH2:46][CH2:47][CH3:48])[cH:44]3)[cH:34]2

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 542642933-(1,3-Benzodioxol-5-yl)-1-(2-bromo-5-propoxyphenyl)-2-propen-1-one

Product 1

HCID 118089983-(1,3-Benzodioxol-5-yl)-6-propoxy-1H-inden-1-one

Sources & evidence

ORD record
ord-ea6dca24f2f741a993fa42b53189ab05
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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