Acetate → HCID 67080359, compound

HRID 89296Notes

Reaction equation

HRID 89296 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][CH2:7][NH:8][C:9](=[O:10])[c:11]2[cH:12][cH:13][c:14]([O:15][c:16]3[c:17]([Cl:31])[cH:18][c:19]4[c:24]([cH:25]3)[O:23][CH2:22][CH2:21][CH:20]4[C:26](=[O:27])[O:28][CH2:29][CH3:30])[cH:32][cH:33]2)[cH:34][cH:35]1.[CH3:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1.[CH:44]1([P:45]([CH:49]2[CH2:50][CH2:51][CH2:52][CH2:53][CH2:54]2)[CH:57]2[CH2:48][CH2:47][CH2:46][CH2:61][CH2:62]2)[CH2:55][CH2:56][CH2:58][CH2:59][CH2:60]1.[CH:63]1([B:64]([OH:65])[OH:66])[CH2:67][CH2:68]1.[K+:41].[K+:42].[K+:43].[O-:77][C:78]([CH3:79])=[O:80].[O-:81][C:82]([CH3:83])=[O:84].[OH2:85].[P:36]([O-:37])([O-:38])([O-:39])=[O:40].[Pd+2:76]>>[c:2]1([CH:61]2[CH2:57][CH2:62]2)[cH:3][cH:4][c:5]([CH2:6][CH2:7][NH:8][C:9](=[O:10])[c:11]2[cH:12][cH:13][c:14]([O:15][c:16]3[c:17]([Cl:31])[cH:18][c:19]4[c:24]([cH:25]3)[O:23][CH2:22][CH2:21][CH:20]4[C:26](=[O:27])[O:28][CH2:29][CH3:30])[cH:32][cH:33]2)[cH:34][cH:35]1

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 67080410Ethyl 7-(4-(4-bromophenethylcarbamoyl)phenoxy)-6-chlorochroman-4-carboxylate

Product 1

HCID 67080359HCID 67080359, compound

Sources & evidence

ORD record
ord-2db558578c654cf29dfaaf58d55b7a7d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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