Hexane → 3-Methyl-5-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]cyclohexan-1-one

HRID 321197Notes

Reaction equation

HRID 321197 reaction equation
[CH2:5]([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[O:12][c:13]1[c:14]([CH:28]2[CH2:29][CH:30]=[CH:31][C:32](=[O:34])[CH2:33]2)[cH:15][cH:16][c:17]([C:19]([CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])([CH3:26])[CH3:27])[cH:18]1.[CH3:2][Cu:3][CH3:4].[CH3:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40].[Li:1]>>[CH3:2][CH:30]1[CH2:29][CH:28]([c:14]2[c:13]([O:12][CH2:5][c:6]3[cH:7][cH:8][cH:9][cH:10][cH:11]3)[cH:18][c:17]([C:19]([CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])([CH3:26])[CH3:27])[cH:16][cH:15]2)[CH2:33][C:32](=[O:34])[CH2:31]1

Participants

5

Reactant 4

HCID 8058HexaneHCID 3028194LithiumHCID 127882935-(2-Benzyloxy-4-(1,1-dimethylheptyl)phenyl]-2-cyclohexen-1-oneHCID 178477770HCID 178477770, compound

Product 1

HCID 204968463-Methyl-5-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]cyclohexan-1-one

Sources & evidence

ORD record
ord-841f2e8a80ca4111ad87d31bc5fa01ad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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