| Identification |
| Name: | 1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-1-(2-propyn-1-yl)- |
| Synonyms: | 1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-1-(2-propynyl)- (9CI); Theobromine, 1-(2-propynyl)-(7CI,8CI); 3,7-Dimethyl-1-propargylxanthine; DMPX; NSC 242985 |
| CAS: | 14114-46-6 |
| Molecular Formula: | C10H10 N4 O2 |
| Molecular Weight: | 218.21 |
| InChI: | InChI=1/C10H10N4O2/c1-4-5-14-9(15)7-8(11-6-12(7)2)13(3)10(14)16/h1,6H,5H2,2-3H3 |
| Molecular Structure: |
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| Properties |
| Flash Point: | 222.3°C |
| Boiling Point: | 443.9°Cat760mmHg |
| Density: | 1.31g/cm3 |
| Refractive index: | 1.638 |
| Flash Point: | 222.3°C |
| Color: | white |
| Safety Data |
| Hazard Symbols |
Xi: Irritant
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