Acetate → HCID 11047852, compound

HRID 108788Notes

Reaction equation

HRID 108788 reaction equation
[Br-:46].[C:72]([O-:73])(=[O:74])[CH3:75].[C:77]([O-:78])(=[O:79])[CH3:80].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[cH:12][c:13]([CH2:21][n:22]3[cH:23][cH:24][c:25]([C:26]([OH:27])([CH2:28][CH3:29])[CH2:30][C:31]([O:32][C:33]([CH3:34])([CH3:35])[CH3:36])=[O:37])[cH:38][c:39]3=[O:40])[c:14]([I:20])[n:15][c:16]2[cH:17][c:18]1[F:19].[CH2:64]([OH:65])[CH2:66][CH2:67][CH2:68][CH3:69].[CH3:42][C:43]([O-:44])=[O:45].[CH3:47][CH2:48][CH2:49][CH2:50][N+:51]([CH2:52][CH2:53][CH2:54][CH3:55])([CH2:56][CH2:57][CH2:58][CH3:59])[CH2:60][CH2:61][CH2:62][CH3:63].[CH3:70][OH:71].[K+:41].[Pd+2:76]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[cH:12][c:13]([CH2:21][OH:44])[c:14]([I:20])[n:15][c:16]2[cH:17][c:18]1[F:19]

Participants

9

Reactant 8

HCID 175Acetate3×HCID 259Bromide ionHCID 813Potassium CationHCID 887MethanolHCID 62761-PentanolHCID 16028TetrabutylammoniumHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 10908472HCID 10908472, compound

Product 1

HCID 11047852HCID 11047852, compound

Sources & evidence

ORD record
ord-d7b0d9c9010945e19fc8708bdfe22e9a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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