Acetic Acid → 2-Cyclopenten-1-one, 3-methyl-2-(3-methyl-2-butenyl)-

HRID 89747

Reaction equation

HRID 89747 reaction equation
[CH2:8]([CH:9]=[C:10]([CH3:11])[CH3:12])[Cl:13].[CH3:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[CH3:1][C:2]1=[CH:3][C:4](=[O:7])[CH2:5][CH2:6]1.[CH3:23][C:24](=[O:25])[OH:26].[Na+:22].[OH-:21].[OH2:27]>>[CH3:1][C:2]1=[C:3]([CH2:8][CH:9]=[C:10]([CH3:11])[CH3:12])[C:4](=[O:7])[CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 1140TolueneHCID 104291-Chloro-3-methyl-2-buteneHCID 176913-Methyl-2-cyclopenten-1-one

Product 1

HCID 147584872-Cyclopenten-1-one, 3-methyl-2-(3-methyl-2-butenyl)-

Sources & evidence

ORD record
ord-fdbe7e028eb542ce9fe122fef635f8f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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