Water → HCID 178419885, compound

HRID 1213708Notes

Reaction equation

HRID 1213708 reaction equation
[Br:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[c:11]1[CH2:10][O:9][C:8]([NH:12][CH:13]1[CH2:14][CH2:15][c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]31)=[N:7]2.[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[CH:22]1([B:25]([OH:26])[OH:27])[CH2:23][CH2:24]1.[CH:28]1([P:29]([CH:30]2[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]2)[CH:36]2[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]2)[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]1.[OH2:47].[Pd:55]>>[c:2]1([CH:22]2[CH2:23][CH2:24]2)[cH:3][cH:4][cH:5][c:6]2[c:11]1[CH2:10][O:9][C:8]([NH:12][CH:13]1[CH2:14][CH2:15][c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]31)=[N:7]2

Participants

7

Reactant 6

HCID 962WaterHCID 1140TolueneHCID 23938PalladiumHCID 75806TricyclohexylphosphineHCID 2760897Cyclopropylboronic acidHCID 178419340HCID 178419340, compound

Product 1

HCID 178419885HCID 178419885, compound

Sources & evidence

ORD record
ord-504fe368fe484c5eb461e8dbb0f9dcc3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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