Diethyl Ether → 5-(3-Hydroxy-4-fluorophenylethynyl)-nicotinonitrile

HRID 2146051Notes

Reaction equation

HRID 2146051 reaction equation
[C:1](#[CH:2])[c:3]1[cH:4][n:5][cH:6][c:7]([C:8]#[N:9])[cH:10]1.[C:20]([P:21]([C:22]([CH3:23])([CH3:24])[CH3:25])[C:26]([CH3:27])([CH3:28])[CH3:29])([CH3:30])([CH3:31])[CH3:32].[CH2:33]([NH:34][CH2:35][CH3:36])[CH3:37].[CH2:38]1[O:39][CH2:40][CH2:41][O:42][CH2:43]1.[CH3:44][CH2:45][O:46][CH2:47][CH3:48].[Cu:49][I:50].[F:11][c:12]1[c:13]([OH:19])[cH:14][c:15]([I:18])[cH:16][cH:17]1>>[C:1](#[C:2][c:15]1[cH:14][c:13]([OH:19])[c:12]([F:11])[cH:17][cH:16]1)[c:3]1[cH:4][n:5][cH:6][c:7]([C:8]#[N:9])[cH:10]1

Participants

8

Reactant 7

HCID 3283Diethyl EtherHCID 8021DiethylamineHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 312751,4-DioxaneHCID 83681Tris(1,1-dimethylethyl)phosphineHCID 224165635-EthynylnicotinonitrileHCID 469118322-Fluoro-5-iodophenol

Product 1

HCID 670478145-(3-Hydroxy-4-fluorophenylethynyl)-nicotinonitrile

Sources & evidence

ORD record
ord-6a70e53aace74d669355198e00ccc869
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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