Bromide ion → HCID 68497799, compound

HRID 177507Notes

Reaction equation

HRID 177507 reaction equation
[Br-:39].[C:33](=[O:34])([O-:35])[O-:36].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[cH:7][c:8]([NH:12][C:13](=[O:14])[c:15]2[o:16][c:17]([Br:20])[cH:18][cH:19]2)[cH:9][cH:10][cH:11]1)=[O:21].[CH2:40]([N+:41]([CH2:42][CH2:43][CH2:44][CH3:45])([CH2:46][CH2:47][CH2:48][CH3:49])[CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH3:56].[CH3:22][O:23][c:24]1[cH:25][cH:26][c:27]([B:30]([OH:31])[OH:32])[cH:28][cH:29]1.[K+:37].[K+:38].[OH2:57].[Pd:58]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[cH:7][c:8]([NH:12][C:13](=[O:14])[c:15]2[o:16][c:17](-[c:27]3[cH:26][cH:25][c:24]([O:23][CH3:22])[cH:29][cH:28]3)[cH:18][cH:19]2)[cH:9][cH:10][cH:11]1)=[O:21]

Participants

9

Reactant 8

HCID 259Bromide ionHCID 813Potassium Cation2×HCID 962WaterHCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 23938PalladiumHCID 201262(4-Methoxyphenyl)boronic acidHCID 59654709HCID 59654709, compound

Product 1

HCID 68497799HCID 68497799, compound

Sources & evidence

ORD record
ord-3d21f3e6428c4033969794bfa36e2368
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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