1,3-dimethyl-7-[[(2S)-1-oxo-1,3-dithiolan-2-yl]methyl]purine-2,6-dione

Names

[ Name ]:
1,3-dimethyl-7-[[(2S)-1-oxo-1,3-dithiolan-2-yl]methyl]purine-2,6-dione

[Synonym ]:
1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-(1,3-dithiolan-2-ylmethyl)-,S-oxide,cis
cis-7-(1,3-Dithiolan-2-ylmethyl)theophylline-1S-oxide
trans-7-(1,3-dithiolan-2-ylmethyl)theophylline-1S-oxide
cis-3,7-Dihydro-1,3-dimethyl-7-(1,3-dithiolan-2-ylmethyl)-1H-purine-2,6-dione S-oxide

Chemical & Physical Properties

[ Density]:
1.76g/cm3

[ Boiling Point ]:
685.3ºC at 760mmHg

[ Molecular Formula ]:
C₁₁H₁₄N₄O₃S₂

[ Molecular Weight ]:
314.38400

[ Flash Point ]:
368.3ºC

[ Exact Mass ]:
314.05100

[ PSA ]:
123.40000

[ LogP ]:
0.12100

[ Vapour Pressure ]:
1.24E-18mmHg at 25°C

[ Index of Refraction ]:
1.835