Potassium Cation → 5-Bromo-[1,1'-biphenyl]-3-carbonitrile

HRID 292952Notes

Reaction equation

HRID 292952 reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][c:8]([Br:10])[cH:9]1.[CH3:103][O:104][CH2:105][CH2:106][O:107][CH3:108].[K+:20].[K+:21].[O-:22][C:23]([O-:24])=[O:25].[OH:11][B:12]([OH:13])[c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1.[cH:26]1[cH:27][cH:28][c:29]([P:30]([Pd:31]([P:32]([c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)([c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[cH:101][cH:102]1>>[c:2]1(-[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:3][c:4]([C:5]#[N:6])[cH:7][c:8]([Br:10])[cH:9]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 66827Phenylboronic AcidHCID 27976903,5-DibromobenzonitrileHCID 178420554HCID 178420554, compound

Product 1

HCID 595881515-Bromo-[1,1'-biphenyl]-3-carbonitrile

Sources & evidence

ORD record
ord-a541addc14494afca7341b191c673ef8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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