Chloride → Chloride

HRID 107210Notes

Reaction equation

HRID 107210 reaction equation
[CH3:19][C:20]1([CH3:31])[CH:21]([C:28](=[O:29])[O-:30])[CH:22]1[CH:23]=[CH:24][C:25](=[O:26])[OH:27].[CH3:2][C:3]1([CH3:18])[CH:4]([C:15](=[O:16])[OH:17])[CH2:5][CH2:6][CH2:7][CH:8]1[CH:9]=[CH:10][C:11]([O:12][CH3:13])=[O:14].[Cl-:1].[OH:32][CH2:33][CH:34]=[CH2:35]>>[CH3:19][C:20]1([CH3:31])[CH:21]([C:28](=[O:29])[O-:30])[CH:22]1[CH:23]=[CH:24][C:25](=[O:26])[O:27][CH2:35][CH:34]=[CH2:33].[CH3:2][C:3]1([CH3:18])[CH:4]([C:15](=[O:16])[OH:17])[CH2:5][CH2:6][CH2:7][CH:8]1[CH:9]=[CH:10][C:11]([O:12][CH3:13])=[O:14].[Cl-:1]

Participants

7

Reactant 4

HCID 312ChlorideHCID 7858Allyl AlcoholHCID 703912833-(3-Methoxy-3-oxoprop-1-enyl)-2,2-dimethylcyclohexane-1-carboxylic acidHCID 735091832,2-Dimethyl-3-(3-hydroxy-3-oxo-1-propenyl)-cyclopropane-carboxylate

Product 3

HCID 312ChlorideHCID 703912833-(3-Methoxy-3-oxoprop-1-enyl)-2,2-dimethylcyclohexane-1-carboxylic acidHCID 736755802,2-Dimethyl-3-(3-allyloxy-3-oxo-1-propenyl)-cyclopropane-carboxylate

Sources & evidence

ORD record
ord-98e885eedfb94caa9ddd54efeba73a41
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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