Acetate → HCID 69305853, compound

HRID 1209818Notes

Reaction equation

HRID 1209818 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][c:10]1[cH:11][cH:12][c:13]([F:16])[cH:14][cH:15]1)[C:17]([NH:18][c:19]1[c:20]([F:26])[cH:21][c:22]([I:25])[cH:23][cH:24]1)=[O:27])=[O:28].[C:68]([O-:69])(=[O:70])[CH3:71].[C:73]([O-:74])(=[O:75])[CH3:76].[CH3:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[CH3:62][CH2:63][O:64][C:65](=[O:66])[CH3:67].[CH:29]1([B:32]([OH:33])[OH:34])[CH2:30][CH2:31]1.[CH:35]1([P:36]([CH:37]2[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42]2)[CH:43]2[CH2:44][CH2:45][CH2:46][CH2:47][CH2:48]2)[CH2:49][CH2:50][CH2:51][CH2:52][CH2:53]1.[OH2:61].[Pd+2:72]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][c:10]1[cH:11][cH:12][c:13]([F:16])[cH:14][cH:15]1)[C:17]([NH:18][c:19]1[c:20]([F:26])[cH:21][c:22]([CH:29]2[CH2:30][CH2:31]2)[cH:23][cH:24]1)=[O:27])=[O:28]

Participants

9

Reactant 8

HCID 175Acetate2×HCID 962WaterHCID 1140TolueneHCID 8857Ethyl AcetateHCID 75806TricyclohexylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 2760897Cyclopropylboronic acidHCID 178453273HCID 178453273, compound

Product 1

HCID 69305853HCID 69305853, compound

Sources & evidence

ORD record
ord-4280a423a7fb4aa2878c3dc4392f494d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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