| Identification |
| Name: | 2H-Purin-2-one,1,3,6,9-tetrahydro-1,3-dimethyl-8-[(3-methylbutyl)thio]-6-thioxo- |
| Synonyms: | Theophylline,8-(isopentylthio)-6-thio- (7CI,8CI); NSC 99677 |
| CAS: | 6492-96-2 |
| Molecular Formula: | C12H18 N4 O S2 |
| Molecular Weight: | 298.4275 |
| InChI: | InChI=1/C12H18N4OS2/c1-7(2)5-6-19-11-13-8-9(14-11)15(3)12(17)16(4)10(8)18/h7H,5-6H2,1-4H3,(H,13,14) |
| Molecular Structure: |
 |
| Properties |
| Flash Point: | 245.7°C |
| Boiling Point: | 482.6°C at 760 mmHg |
| Density: | 1.35g/cm3 |
| Refractive index: | 1.656 |
| Flash Point: | 245.7°C |
| Safety Data |
| |
 |
