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6H-Purin-6-one,1,2,3,9-tetrahydro-1,3-dimethyl-8-[(4-pyridinylmethyl)thio]-2-thioxo- (6466-16-6)

Identification
Name:6H-Purin-6-one,1,2,3,9-tetrahydro-1,3-dimethyl-8-[(4-pyridinylmethyl)thio]-2-thioxo-
Synonyms:Theophylline,8-[(4-pyridylmethyl)thio]-2-thio- (7CI,8CI); NSC 99665
CAS:6466-16-6
Molecular Formula: C13H13 N5 O S2
Molecular Weight: 319.4052
InChI: InChI=1/C13H13N5OS2/c1-17-10-9(11(19)18(2)13(17)20)15-12(16-10)21-7-8-3-5-14-6-4-8/h3-6H,7H2,1-2H3,(H,15,16)
Molecular Structure: (C13H13N5OS2) Theophylline,8-[(4-pyridylmethyl)thio]-2-thio- (7CI,8CI); NSC 99665
Properties
Flash Point: 306.7°C
Boiling Point: 583.5°Cat760mmHg
Density:1.54g/cm3
Refractive index:1.758
Flash Point: 306.7°C
Safety Data
 

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