Potassium Cation → 1-Bromo-2-(cyclopropylsulfanyl)benzene

HRID 1211207Notes

Reaction equation

HRID 1211207 reaction equation
[Br:1][c:2]1[c:3]([SH:8])[cH:4][cH:5][cH:6][cH:7]1.[Br:9][CH:10]1[CH2:11][CH2:12]1.[C:13](=[O:14])([O-:15])[O-:16].[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[K+:17].[K+:18].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[OH2:50].[c:19]1([C:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[SH:33])[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[Br:1][c:2]1[c:3]([S:8][CH:10]2[CH2:11][CH2:12]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 77281Benzenemethanethiol, alpha,alpha-diphenyl-HCID 78037BromocyclopropaneHCID 805982-Bromobenzenethiol

Product 1

HCID 595709161-Bromo-2-(cyclopropylsulfanyl)benzene

Sources & evidence

ORD record
ord-23b17da295b94dd0920eba56e93c8eda
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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