dimethyl-[2-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)sulfanylethyl]azanium,chloride

Names

[ Name ]:
dimethyl-[2-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)sulfanylethyl]azanium,chloride

[Synonym ]:
CAFFEINE,8-((2-(DIMETHYLAMINO)ETHYL)THIO)-,HYDROCHLORIDE
dimethyl-[2-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)sulfanylethyl]azanium chloride
8-((2-(Dimethylamino)ethyl)thio)caffeine hydrochloride
N,N-dimethyl-2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]ethanaminium chloride

Chemical & Physical Properties

[ Boiling Point ]:
469ºC at 760 mmHg

[ Molecular Formula ]:
C₁₂H₂₀ClN₅O₂S

[ Molecular Weight ]:
333.83800

[ Flash Point ]:
237.4ºC

[ Exact Mass ]:
333.10300

[ PSA ]:
90.36000

[ LogP ]:
0.42640

[ Vapour Pressure ]:
5.74E-09mmHg at 25°C