Bromide ion → 3,4'-Dimethoxybiphenyl

HRID 1572554Notes

Reaction equation

HRID 1572554 reaction equation
[Br-:27].[C:21](=[O:22])([O-:23])[O-:24].[CH2:46]([OH:47])[CH3:48].[CH3:1][O:2][c:3]1[cH:4][c:5]([B:9]([OH:10])[OH:11])[cH:6][cH:7][cH:8]1.[CH3:28][CH2:29][CH2:30][CH2:31][N+:32]([CH2:33][CH2:34][CH2:35][CH3:36])([CH2:37][CH2:38][CH2:39][CH3:40])[CH2:41][CH2:42][CH2:43][CH3:44].[I:12][c:13]1[cH:14][cH:15][c:16]([O:19][CH3:20])[cH:17][cH:18]1.[K+:25].[K+:26].[OH2:45].[c:49]1([CH3:50])[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[CH3:1][O:2][c:3]1[cH:4][c:5](-[c:13]2[cH:14][cH:15][c:16]([O:19][CH3:20])[cH:17][cH:18]2)[cH:6][cH:7][cH:8]1

Participants

10

Reactant 9

HCID 259Bromide ionHCID 702EthanolHCID 813Potassium Cation2×HCID 962WaterHCID 1140TolueneHCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 696764-IodoanisoleHCID 2734370(3-Methoxyphenyl)boronic acid

Product 1

HCID 6118463,4'-Dimethoxybiphenyl

Sources & evidence

ORD record
ord-f0cd0f3aaa0e49ac8d68361663e92ef5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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