Sodium ion → 1,1'-Biphenyl-4-carboxylic acid,4'-(trifluoromethyl)-,ethyl ester

HRID 94197Notes

Reaction equation

HRID 94197 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][cH:12]1.[CH3:32][O:33][CH2:34][CH2:35][O:36][CH3:37].[F:13][C:14]([c:15]1[cH:16][cH:17][c:18]([B:21]([OH:22])[OH:23])[cH:19][cH:20]1)([F:24])[F:25].[Na+:26].[Na+:27].[O-:28][C:29](=[O:30])[O-:31]>>[c:2]1(-[c:18]2[cH:17][cH:16][c:15]([C:14]([F:13])([F:24])[F:25])[cH:20][cH:19]2)[cH:3][cH:4][c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][cH:12]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 22043Ethyl 4-bromobenzoateHCID 27343894-(Trifluoromethyl)phenylboronic acid

Product 1

HCID 547624251,1'-Biphenyl-4-carboxylic acid,4'-(trifluoromethyl)-,ethyl ester

Sources & evidence

ORD record
ord-317e5ce9fa614badb2f279d4da075289
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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