Potassium Cation → 6-Methoxy-5-(pentafluoroethyl)naphthalene-1-carbonitrile

HRID 160999Notes

Reaction equation

HRID 160999 reaction equation
[CH2:41]([Cl:42])[Cl:43].[CH3:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1.[CH3:1][O:2][c:3]1[c:4]([Br:15])[c:5]2[cH:6][cH:7][cH:8][c:9]([C:13]#[N:14])[c:10]2[cH:11][cH:12]1.[CH3:23][N:24]([CH3:25])[CH:26]=[O:27].[Cu:39][I:40].[F:28][C:29]([C:30]([C:31]([O-:32])=[O:33])([F:34])[F:35])([F:36])[F:37].[K+:38].[OH2:44].[OH2:45].[c:46]1([CH3:47])[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[CH3:1][O:2][c:3]1[c:4]([C:30]([C:29]([F:28])([F:36])[F:37])([F:34])[F:35])[c:5]2[cH:6][cH:7][cH:8][c:9]([C:13]#[N:14])[c:10]2[cH:11][cH:12]1

Participants

9

Reactant 8

HCID 813Potassium CationHCID 962Water2×HCID 1140Toluene2×HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 3858030PerfluoropropanoateHCID 139590745-Bromo-6-methoxynaphthalene-1-carbonitrile

Product 1

HCID 139590756-Methoxy-5-(pentafluoroethyl)naphthalene-1-carbonitrile

Sources & evidence

ORD record
ord-a4e7dcef573f47a088e713135808d60f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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