Water → 2-(3-Hydroxy-1,1-dimethylpropyl)-5-methoxyphenol

Reaction equation

[Al+3:17].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:11]([cH:12]1)[O:10][C:9](=[O:13])[CH2:8][C:7]2([CH3:14])[CH3:15].[H-:16].[H-:19].[H-:20].[H-:21].[Li+:18].[OH2:22]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([C:7]([CH2:8][CH2:9][OH:13])([CH3:14])[CH3:15])[c:11]([OH:10])[cH:12]1

Participants

Reactant 5

HCID 962Water

HCID 28486Lithium ion

HCID 104727Aluminum Cation

HCID 166653Hydride4×

HCID 210975117-Methoxy-4,4-dimethylchroman-2-one

Product 1

HCID 210974522-(3-Hydroxy-1,1-dimethylpropyl)-5-methoxyphenol

Sources & evidence

ORD record: ord-8d4cf0bbccbd4419b740e5e15a2e3bf6
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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