Acetate → HCID 178456724, compound

HRID 181176Notes

Reaction equation

HRID 181176 reaction equation
[CH3:1][C:2]([CH3:3])([c:4]1[cH:5][n:6][c:7]([C:10]([F:11])([F:12])[F:13])[cH:8][cH:9]1)[NH:14][CH:15]1[C:16](=[O:38])[N:17]([c:31]2[cH:32][cH:33][c:34]([Br:37])[cH:35][cH:36]2)[CH:18]([c:20]2[cH:21][c:22]([O:26][C:27]([F:28])([F:29])[F:30])[cH:23][cH:24][cH:25]2)[CH2:19]1.[CH3:64][c:65]1[cH:66][cH:67][cH:68][cH:69][cH:70]1.[CH3:72][CH2:73][O:74][C:75](=[O:76])[CH3:77].[CH:39]1([B:42]([OH:43])[OH:44])[CH2:40][CH2:41]1.[CH:45]1([P:46]([CH:47]2[CH2:48][CH2:49][CH2:50][CH2:51][CH2:52]2)[CH:53]2[CH2:54][CH2:55][CH2:56][CH2:57][CH2:58]2)[CH2:59][CH2:60][CH2:61][CH2:62][CH2:63]1.[O-:79][C:80]([CH3:81])=[O:82].[O-:83][C:84]([CH3:85])=[O:86].[OH2:71].[Pd+2:78]>>[CH3:1][C:2]([CH3:3])([c:4]1[cH:5][n:6][c:7]([C:10]([F:11])([F:12])[F:13])[cH:8][cH:9]1)[NH:14][CH:15]1[C:16](=[O:38])[N:17]([c:31]2[cH:32][cH:33][c:34]([CH:39]3[CH2:40][CH2:41]3)[cH:35][cH:36]2)[CH:18]([c:20]2[cH:21][c:22]([O:26][C:27]([F:28])([F:29])[F:30])[cH:23][cH:24][cH:25]2)[CH2:19]1

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 178456723HCID 178456723, compound

Product 1

HCID 178456724HCID 178456724, compound

Sources & evidence

ORD record
ord-daa9e7c150614de3b24d09ec87e5115c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…