Sodium ion → 2-Fluoro-4'-(methanesulfonyl)[1,1'-biphenyl]-4-ol

HRID 679178Notes

Reaction equation

HRID 679178 reaction equation
[Br:14][c:15]1[c:16]([F:22])[cH:17][c:18]([OH:21])[cH:19][cH:20]1.[C:23](=[O:24])([O-:25])[O-:26].[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([B:11]([OH:12])[OH:13])[cH:9][cH:10]1.[CH3:29][O:30][CH2:31][CH2:32][O:33][CH3:34].[Na+:27].[Na+:28].[cH:35]1[cH:36][cH:37][c:38]([P:39]([Pd:40]([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)([P:60]([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[P:79]([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)([c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)[c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)[cH:110][cH:111]1>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[c:15]2[c:16]([F:22])[cH:17][c:18]([OH:21])[cH:19][cH:20]2)[cH:9][cH:10]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 27343644-(Methanesulfonyl)phenylboronic acidHCID 27791534-Bromo-3-fluorophenolHCID 178420554HCID 178420554, compound

Product 1

HCID 532196762-Fluoro-4'-(methanesulfonyl)[1,1'-biphenyl]-4-ol

Sources & evidence

ORD record
ord-5f4f75cf56f54946950e347cd90d5e53
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…