Potassium Cation → 2-Methyl-3-phenylbenzyl 3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylate

HRID 149966Notes

Reaction equation

HRID 149966 reaction equation
[CH2:41]([Cl:42])[Cl:43].[CH3:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH3:24].[CH3:44][CH2:45][O:46][CH2:47][CH3:48].[CH3:49][C:50]#[N:51].[Cl:25][CH2:26][c:27]1[c:28]([CH3:39])[c:29](-[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:30][cH:31][cH:32]1.[Cl:3][C:4](=[CH:5][CH:6]1[C:7]([CH3:12])([CH3:13])[CH:8]1[C:9](=[O:10])[OH:11])[C:14]([F:15])([F:16])[F:17].[K+:2].[OH-:1].[OH2:40]>>[Cl:3][C:4](=[CH:5][CH:6]1[C:7]([CH3:12])([CH3:13])[CH:8]1[C:9](=[O:10])[O:11][CH2:26][c:27]1[c:28]([CH3:39])[c:29](-[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:30][cH:31][cH:32]1)[C:14]([F:15])([F:16])[F:17]

Participants

10

Reactant 9

HCID 813Potassium CationHCID 961HydroxideHCID 962WaterHCID 3283Diethyl EtherHCID 6342AcetonitrileHCID 6344DichloromethaneHCID 8900HeptaneHCID 156507Z-(1R,S)-cis-2,2-dimethyl-3-(2,2-chloro-3,3,3-trifluoro-1-propenyl)cyclopropanecarboxylic acidHCID 132825193-(Chloromethyl)-2-methyl-1,1'-biphenyl

Product 1

HCID 549012-Methyl-3-phenylbenzyl 3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropanecarboxylate

Sources & evidence

ORD record
ord-830652a0487e4d77a285ec0a0afecbb6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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