Potassium Cation → 4-Bromo-2-fluorothioanisole

HRID 2317164Notes

Reaction equation

HRID 2317164 reaction equation
[Br:22][c:23]1[cH:24][c:25]([F:40])[c:26]([S:29][Si:30]([CH:31]([CH3:32])[CH3:33])([CH:34]([CH3:35])[CH3:36])[CH:37]([CH3:38])[CH3:39])[cH:27][cH:28]1.[C:41](=[O:42])([O-:43])[O-:44].[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH2:5]([N+:6]([CH2:7][CH2:8][CH2:9][CH3:10])([CH2:11][CH2:12][CH2:13][CH3:14])[CH2:15][CH2:16][CH2:17][CH3:18])[CH2:19][CH2:20][CH3:21].[CH3:47][I:48].[F-:4].[K+:45].[K+:46].[OH2:1].[OH2:2].[OH2:3]>>[CH3:5][S:29][c:26]1[c:25]([F:40])[cH:24][c:23]([Br:22])[cH:28][cH:27]1

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 962Water3×HCID 6328Methyl iodideHCID 8028TetrahydrofuranHCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 28179Fluoride IonHCID 67084425HCID 67084425, compound

Product 1

HCID 219340644-Bromo-2-fluorothioanisole

Sources & evidence

ORD record
ord-5792010c1aec46fcae01beab77e2c8b4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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