Dimethylformamide → 1,3-Di-cyclohexyl-8-chloro xanthine

HRID 100977Notes

Reaction equation

HRID 100977 reaction equation
[CH3:32][N:33]([CH3:34])[CH:35]=[O:36].[CH:1]1([n:7]2[c:8](=[O:9])[n:10]([CH:21]3[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]3)[c:11]3[n:12][c:13]([N+:18]([O-:19])=[O:20])[nH:14][c:15]3[c:16]2=[O:17])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[P:27]([Cl:28])([Cl:29])([Cl:30])=[O:31]>>[CH:1]1([n:7]2[c:8](=[O:9])[n:10]([CH:21]3[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26]3)[c:11]3[n:12][c:13]([Cl:29])[nH:14][c:15]3[c:16]2=[O:17])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

4

Reactant 3

HCID 6228DimethylformamideHCID 24813Phosphorus oxychlorideHCID 99688961,3-Di-cyclohexyl-8-nitro xanthine

Product 1

HCID 99245701,3-Di-cyclohexyl-8-chloro xanthine

Sources & evidence

ORD record
ord-dc1ca15f083a42aba042919d0c85d9d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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