| Identification | |
| Name: | 1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-phenyl- |
| Synonyms: | 1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-8-phenyl- (9CI); Theophylline, 8-phenyl-(6CI,7CI,8CI); 1,3-Dimethyl-8-phenylxanthine;3,7-Dihydro-1,3-dimethyl-8-phenyl-1H-purine-2,6-dione; 8-PT;8-Phenyl-1,3-dimethylxanthine; 8-Phenyltheophylline; NSC 14127 |
| CAS: | 961-45-5 |
| Molecular Formula: | C13H12 N4 O2 |
| Molecular Weight: | 256.26 |
| InChI: | InChI=1/C13H12N4O2/c1-16-11-9(12(18)17(2)13(16)19)14-10(15-11)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,14,15) |
| Molecular Structure: |  |
| Properties | |
| Melting Point: | >300 °C(lit.) |
| Flash Point: | 266.9°C |
| Boiling Point: | 517.7°Cat760mmHg |
| Density: | 1.361g/cm3 |
| Refractive index: | 1.639 |
| Flash Point: | 266.9°C |
| Color: | off-white to light yellow |
| Safety Data | |
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