Acetate → 2,2-dimethyl-4-(4-methoxyphenyl)-5-{4-(methylsulfonyl)phenyl}-3(2H)-furanone

HRID 1134128Notes

Reaction equation

HRID 1134128 reaction equation
[Br:1][C:2]1=[C:6]([c:7]2[cH:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[CH3:16])[cH:11][cH:12]2)[O:5][C:4]([CH3:17])([CH3:18])[C:3]1=[O:19].[CH3:55][O:56][c:57]1[cH:58][cH:59][c:60]([B:63]([OH:64])[OH:65])[cH:61][cH:62]1.[Na+:49].[Na+:50].[O-:51][C:52](=[O:53])[O-:54].[O-:73][C:74]([CH3:75])=[O:76].[O-:77][C:78]([CH3:79])=[O:80].[Pd+2:72].[c:20]1([P:21]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[CH2:28][CH2:29][CH2:30][P:31]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[cH:44][cH:45][cH:46][cH:47][cH:48]1.[cH:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1>>[C:2]1([c:60]2[cH:59][cH:58][c:57]([O:56][CH3:55])[cH:62][cH:61]2)=[C:6]([c:7]2[cH:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[CH3:16])[cH:11][cH:12]2)[O:5][C:4]([CH3:17])([CH3:18])[C:3]1=[O:19]

Participants

9

Reactant 8

HCID 175Acetate2×HCID 241BenzeneHCID 923Sodium ion2×HCID 19660Carbonate IonHCID 812191,3-Bis(diphenylphosphino)propaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 201262(4-Methoxyphenyl)boronic acidHCID 183857274-Bromo-2,2-dimethyl-5-[4-(methylsulfonyl)phenyl]-3(2h)-furanone

Product 1

HCID 183855972,2-dimethyl-4-(4-methoxyphenyl)-5-{4-(methylsulfonyl)phenyl}-3(2H)-furanone

Sources & evidence

ORD record
ord-81ac40deb0a649b18a2bdc4dde1fbf3b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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