Chloride → Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, ethyl ester

Reaction equation

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH2:6][CH:7]([C:8]([CH3:9])([Cl:10])[CH3:11])[CH:12]=[C:13]([Cl:14])[Cl:15].[CH2:26]([P+:27]([CH2:28][CH2:29][CH2:30][CH3:31])([CH2:32][CH2:33][CH2:34][CH3:35])[CH2:36][CH2:37][CH2:38][CH3:39])[CH2:40][CH2:41][CH3:42].[CH3:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[Cl-:25].[K+:17].[OH-:16]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH:7]([CH:12]=[C:13]([Cl:14])[Cl:15])[C:8]1([CH3:9])[CH3:11]

Participants

Reactant 6

HCID 312Chloride

HCID 813Potassium Cation

HCID 961Hydroxide

HCID 1140Toluene

HCID 75312Tetrabutylphosphonium cation

HCID 12503855Ethyl 5,5-dichloro-3-(2-chloropropan-2-yl)pent-4-enoate

Product 1

HCID 101094Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, ethyl ester

Sources & evidence

ORD record: ord-6e7c881ba2d54e6dbc3dddd36c657a4e
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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