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ChemicalBook--->CAS DataBase List--->59413-14-8

59413-14-8

59413-14-8 Structure

59413-14-8 Structure
IdentificationBack Directory
[Name]

1-(3-Hydroxypropyl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione
[CAS]

59413-14-8
[Synonyms]

Pentoxifylline Impurity D
Pentoxifylline EP impurity D
1-(3-Hydroxypropyl)theobromine
1-(3-hydroxypropyl)-3,7-dimethylpurine-2,6-dione
Pentoxifylline Impurity 4(Pentoxifylline EP Impurity D)
1-(3-Hydroxypropyl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione
1H-Purine-2,6-dione, 3,7-dihydro-1-(3-hydroxypropyl)-3,7-dimethyl-
1-(3-Hydroxypropyl)-3,7-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
[Molecular Formula]

C10H14N4O3
[MDL Number]

MFCD01682404
[MOL File]

59413-14-8.mol
[Molecular Weight]

238.24
Chemical PropertiesBack Directory
[Melting point ]

142-142.5 °C(Solv: methanol (67-56-1))
[Boiling point ]

380.84°C (rough estimate)
[density ]

1.2560 (rough estimate)
[refractive index ]

1.6200 (estimate)
[pka]

14.88±0.10(Predicted)
Hazard InformationBack Directory
[Uses]

1-(3-Hydroxypropyl)theobromine has an effect in stimulating the peripheral circulation in rats; Also, it is an intermediate used in the synthesis of 1-(3-Bromopropyl)theobromine (B686745), which is a compound useful in organic synthesis.
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