1,2-Dichloroethane → 2-[(2,4-Dimethoxyphenyl)methoxycarbonyl]cyclopentane-1-carboxylic acid

HRID 1137720

Reaction equation

HRID 1137720 reaction equation
[CH2:24]([Cl:25])[CH2:26][Cl:27].[CH3:12][O:13][c:14]1[c:15]([CH2:16][OH:17])[cH:18][cH:19][c:20]([O:22][CH3:23])[cH:21]1.[CH3:29][N:30]([c:31]1[cH:32][cH:33][n:34][cH:35][cH:36]1)[CH3:37].[CH:1]1([C:9](=[O:10])[OH:11])[CH:2]([C:6](=[O:7])[OH:8])[CH2:3][CH2:4][CH2:5]1.[ClH:28].[Na+:48].[O-:44][C:45]([OH:46])=[O:47].[O:38]=[CH:39][N:40]([CH3:41])[CH3:42].[OH2:43]>>[CH:1]1([C:9](=[O:10])[OH:11])[CH:2]([C:6]([O:7][CH2:16][c:15]2[c:14]([O:13][CH3:12])[cH:21][c:20]([O:22][CH3:23])[cH:19][cH:18]2)=[O:8])[CH2:3][CH2:4][CH2:5]1

Participants

10

Reactant 9

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 142844-(Dimethylamino)pyridineHCID 817502,4-Dimethoxybenzyl alcoholHCID 895541,2-Cyclopentanedicarboxylate

Product 1

HCID 671537432-[(2,4-Dimethoxyphenyl)methoxycarbonyl]cyclopentane-1-carboxylic acid

Sources & evidence

ORD record
ord-4e831eb5417d4bdea241fbf0a228fa10
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Linked notes

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