Acetate → HCID 67000912, compound

HRID 208828Notes

Reaction equation

HRID 208828 reaction equation
[Br:1][c:2]1[c:3]2[n:4]([cH:5][c:6](-[c:8]3[cH:9][cH:10][c:11]([C:14]([F:15])([F:16])[F:17])[cH:12][cH:13]3)[cH:7]1)[cH:18][cH:19][n:20]2.[C:54]([O-:55])(=[O:56])[CH3:57].[C:59]([O-:60])(=[O:61])[CH3:62].[CH3:64][c:65]1[cH:66][cH:67][cH:68][cH:69][cH:70]1.[CH:21]1([B:24]([OH:25])[OH:26])[CH2:22][CH2:23]1.[CH:27]1([P:28]([CH:29]2[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]2)[CH:35]2[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2)[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]1.[K+:51].[K+:52].[K+:53].[OH2:63].[P:46]([O-:47])([O-:48])([O-:49])=[O:50].[Pd+2:58]>>[c:2]1([CH:21]2[CH2:22][CH2:23]2)[c:3]2[n:4]([cH:5][c:6](-[c:8]3[cH:9][cH:10][c:11]([C:14]([F:15])([F:16])[F:17])[cH:12][cH:13]3)[cH:7]1)[cH:18][cH:19][n:20]2

Participants

10

Reactant 9

HCID 175Acetate2×HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 1140TolueneHCID 75806TricyclohexylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 2760897Cyclopropylboronic acidHCID 67000913HCID 67000913, compound

Product 1

HCID 67000912HCID 67000912, compound

Sources & evidence

ORD record
ord-6c36942da95e4b8e9cb8f1e89b47621c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…