1-n-Hexyltheobromine
Product Description
| Product | 1-n-Hexyltheobromine |
| CAS | 1028-33-7 |
| Formula | C13H20N4O2 |
| Synonym | 1H-Purine-2,6-dione, 1-hexyl-3,7-dihydro-3,7-dimethyl-, 1H-Purine-2,6-dione, 3,7-dihydro-1-hexyl-3,7-dimethyl-, Cosadon, Cosaldon, 1-Hexyl-3,7-dimethylxanthine, Hexyltheobromine, 1-Hexyltheobromine, Pentifyllin, SK 7, Theobromine, 1-hexyl-, 1-Hexyl-3,7-dihydro-3,7-dimethyl-1H-purine-2,6-dione, 3,7-Dimethyl-1-hexyl-1H,3H-purin-2,6-dione, SK 7 (pharmaceutical) |
Typical Product Specifications
| Molecular weight | 264.32 |
| InChI | 1S/C13H20N4O2/c1-4-5-6-7-8-17-12(18)10-11(14-9-15(10)2)16(3)13(17)19/h9H,4-8H2,1-3H3 |
| log P (octanol-water) | 2.610 |
| Vapor Pressure | 6.11E-10 mm Hg |
| Water solubility | 116 mg/L |
| Henry's Law Constant | 1.48E-10 atm-m3/mole |
| Melting Point | 82.5 ° C |
| Atmospheric OH Rate Constant | 2.91E-11 cm3/molecule-sec |
| Class | Specialty Chemicals |
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