Ethanol → 3-(4-Bromophenyl)pyridine

HRID 171428Notes

Reaction equation

HRID 171428 reaction equation
[Br:10][c:11]1[cH:12][cH:13][c:14]([I:17])[cH:15][cH:16]1.[CH3:102][CH2:103][OH:104].[CH3:105][O:106][CH2:107][CH2:108][O:109][CH3:110].[Na+:18].[Na+:19].[O-:20][C:21](=[O:22])[O-:23].[OH2:101].[cH:24]1[cH:25][cH:26][c:27]([P:28]([Pd:29]([P:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[P:68]([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)([c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)[cH:99][cH:100]1.[n:1]1[cH:2][c:3]([B:7]([OH:8])[OH:9])[cH:4][cH:5][cH:6]1>>[n:1]1[cH:2][c:3](-[c:14]2[cH:13][cH:12][c:11]([Br:10])[cH:16][cH:15]2)[cH:4][cH:5][cH:6]1

Participants

9

Reactant 8

HCID 702EthanolHCID 923Sodium ion2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 115221-Bromo-4-iodobenzeneHCID 19660Carbonate IonHCID 27343783-Pyridinylboronic acidHCID 178420554HCID 178420554, compound

Product 1

HCID 15152413-(4-Bromophenyl)pyridine

Sources & evidence

ORD record
ord-f9aa06b640f04da7a7314c5f8b4a0035
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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