Pentoxifylline → 1-(5-Oxohexyl)-3,7-dimethyl-8-(trifluoromethyl)-1,2,3,6-tetrahydro-7H-purine-2,6-dione

HRID 2418910Notes

Reaction equation

HRID 2418910 reaction equation
CC(=O)CCCCn1c(=O)c2c(ncn2C)n(C)c1=O.O=S(O)C(F)(F)F.[Zn]>CC(C)(C)OO.Fc1c(F)c(F)c(C(F)(F)F)c(F)c1F.O>CC(=O)CCCCn1c(=O)c2c(nc(C(F)(F)F)n2C)n(C)c1=O

Participants

6

Reactant 2

HCID 4740PentoxifyllineHCID 89601280CID 89601280

Product 1

HCID 1018761991-(5-Oxohexyl)-3,7-dimethyl-8-(trifluoromethyl)-1,2,3,6-tetrahydro-7H-purine-2,6-dioneYield 79%

Reagents, catalysts & solvents 3

HCID 6410tert-Butyl hydroperoxideReagentHCID 962WaterSolventHCID 9906OctafluorotolueneSolvent

Conditions

Temperature
25 °C

Sources & evidence

ORD record
ord-aff7dcedb0bd47c1bdd70b0572644e6a
Source dataset
Minisci dataset from Roche

Reaction notes

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