Acetone → 1,3-Dibutyl-7-methanesulfonyl-3,7-dihydro-purine-2,6-dione

HRID 285959

Reaction equation

HRID 285959 reaction equation
[C:20](=[O:21])([O-:22])[O-:23].[CH2:1]([CH2:2][CH2:3][CH3:4])[n:5]1[c:6](=[O:19])[n:7]([CH2:15][CH2:16][CH2:17][CH3:18])[c:8]2[n:9][cH:10][nH:11][c:12]2[c:13]1=[O:14].[CH3:26][S:27]([Cl:28])(=[O:29])=[O:30].[CH3:31][C:32](=[O:33])[CH3:34].[K+:24].[K+:25]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[n:5]1[c:6](=[O:19])[n:7]([CH2:15][CH2:16][CH2:17][CH3:18])[c:8]2[n:9][cH:10][n:11]([S:27]([CH3:26])(=[O:29])=[O:30])[c:12]2[c:13]1=[O:14]

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 31297Methanesulfonyl chlorideHCID 1014211,3-Dibutylxanthine

Product 1

HCID 105452551,3-Dibutyl-7-methanesulfonyl-3,7-dihydro-purine-2,6-dione

Sources & evidence

ORD record
ord-0b3b6cf0d96d4c6dbd9d8678b241b45e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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