Pentoxifylline

About This Item

Molecular Formula	C₁₃H₁₈N₄O₃
CAS Number	6493-05-6

FC-0010977

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Properties

Chemical Identifiers

IUPAC Name	3,7-dimethyl-1-(5-oxohexyl)purine-2,6-dione
SMILES	CC(=O)CCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C
InChI Key	BYPFEZZEUUWMEJ-UHFFFAOYSA-N
InChI	InChI=1S/C13H18N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8H,4-7H2,1-3H3

Physical Properties

Boiling Point	531.3±56.0 °C at 760 mmHg
Melting Point	105°C
Flash Point	275.1±31.8 °C
Density	1.3±0.1 g/cm3

Safety Information

Hazard Class

Warning

Flash Point

275.1±31.8 °C

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.