1,3-dimethyl-7-(trideuteriomethyl)purine-2,6-dione

Controlled Substances

Psychoactive Drugs/Narcotic Drugs/Hypertoxic Chemicals/Non-Medical Use of Narcotic Drugs and Psychotropic Substances

Names

[ CAS No. ]:
26351-04-2

[ Name ]:
1,3-dimethyl-7-(trideuteriomethyl)purine-2,6-dione

[Synonym ]:
1,3-dimethyl-7-trideuteriomethyl-3,7-dihydro-purine-2,6-dione
1,3-Dimethyl-7-(H)methyl-3,7-dihydro-1H-purine-2,6-dione
1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(methyl-d)-
7-trideuteriomethyl-1,3-dimethylxanthine
7-Trideuteromethyl-1,3-dimethylxanthine
7,7,7-Caffeine-d3

Chemical & Physical Properties

[ Density]:
1.5±0.1 g/cm3

[ Boiling Point ]:
416.8±37.0 °C at 760 mmHg

[ Molecular Formula ]:
C8H7D3N4O2

[ Molecular Weight ]:
197.209

[ Flash Point ]:
205.9±26.5 °C

[ Exact Mass ]:
197.099213

[ PSA ]:
61.82000

[ LogP ]:
-0.13

[ Vapour Pressure ]:
0.0±1.0 mmHg at 25°C

[ Index of Refraction ]:
1.679

Related Compounds