Acetate → HCID 76835089, compound

HRID 197975Notes

Reaction equation

HRID 197975 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5](-[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[c:6]([CH2:14][C:15](=[O:16])[NH:17][c:18]3[c:19]([C:25]([F:26])([F:27])[F:28])[cH:20][c:21]([F:24])[cH:22][cH:23]3)[c:7](=[O:13])[o:8][c:9]2[cH:10][c:11]1[CH3:12].[C:35]([CH:36]=[CH2:37])(=[O:38])[O:39][CH3:40].[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[O-:73][C:74]([CH3:75])=[O:76].[O-:77][C:78]([CH3:79])=[O:80].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[OH2:81].[Pd+2:72].[c:48]1([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[cH:62][cH:63][cH:64][cH:65][cH:66]1>>[c:2]1([CH:37]=[CH:36][C:35](=[O:38])[O:39][CH3:40])[cH:3][c:4]2[c:5](-[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[c:6]([CH2:14][C:15](=[O:16])[NH:17][c:18]3[c:19]([C:25]([F:26])([F:27])[F:28])[cH:20][c:21]([F:24])[cH:22][cH:23]3)[c:7](=[O:13])[o:8][c:9]2[cH:10][c:11]1[CH3:12]

Participants

9

Reactant 8

HCID 175Acetate2×HCID 962WaterHCID 6228DimethylformamideHCID 7294Methyl AcrylateHCID 8471TriethylamineHCID 11776TriphenylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 22267271HCID 22267271, compound

Product 1

HCID 76835089HCID 76835089, compound

Sources & evidence

ORD record
ord-9521c48b9eac4f3db758b5e0e14395ce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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