Ammonium → 4-Hydroxy-5,5-dimethylcyclopent-2-enone

HRID 125108

Reaction equation

HRID 125108 reaction equation
[BH4-:21].[CH3:12][C:13]1([CH3:20])[C:14](=[O:19])[CH:15]=[CH:16][C:17]1=[O:18].[CH3:25][OH:26].[CH3:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32].[CH3:33][CH2:34][O:35][CH2:36][CH3:37].[Ce+3:9].[Cl-:10].[Cl-:11].[Cl-:23].[Cl-:8].[NH4+:24].[Na+:22].[OH2:1].[OH2:2].[OH2:3].[OH2:4].[OH2:5].[OH2:6].[OH2:7]>>[CH3:12][C:13]1([CH3:20])[CH:14]([OH:19])[CH:15]=[CH:16][C:17]1=[O:18]

Participants

11

Reactant 10

HCID 223AmmoniumHCID 312Chloride4×HCID 887MethanolHCID 923Sodium ionHCID 962Water7×HCID 3283Diethyl EtherHCID 8058HexaneHCID 28123BorohydrideHCID 114853Cerium(3+)HCID 45746952,2-Dimethylcyclopent-4-ene-1,3-dione

Product 1

HCID 111371664-Hydroxy-5,5-dimethylcyclopent-2-enone

Sources & evidence

ORD record
ord-738dee9c65d4428ea6d0c81c6bf29d77
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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