Acetate → HCID 10732886, compound

HRID 1137173Notes

Reaction equation

HRID 1137173 reaction equation
[C:52]([O-:53])(=[O:54])[CH3:55].[C:57]([O-:58])(=[O:59])[CH3:60].[CH3:20][O:21][C:22]([c:23]1[c:24]([NH2:34])[cH:25][c:26]([C:27](=[O:28])[O:29][CH3:30])[c:31]([Br:33])[cH:32]1)=[O:35].[CH3:36][c:37]1[c:38]([B:43]([OH:44])[OH:45])[cH:39][cH:40][cH:41][cH:42]1.[CH3:61][CH2:62][OH:63].[Na+:46].[Na+:47].[O-:48][C:49](=[O:50])[O-:51].[Pd+2:56].[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>>[CH3:20][O:21][C:22]([c:23]1[c:24]([NH2:34])[cH:25][c:26]([C:27](=[O:28])[O:29][CH3:30])[c:31](-[c:38]2[c:37]([CH3:36])[cH:42][cH:41][cH:40][cH:39]2)[cH:32]1)=[O:35]

Participants

9

Reactant 8

HCID 175Acetate2×HCID 702EthanolHCID 923Sodium ion2×HCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27332672-Methylphenyl boronic acidHCID 23436066Dimethyl 2-amino-5-bromobenzene-1,4-dicarboxylate

Product 1

HCID 10732886HCID 10732886, compound

Sources & evidence

ORD record
ord-96cfb3166a304186ba368c61ff0aa62d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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