1,3-dimethyl-7-[[(2S)-1-oxo-1,3-dithiolan-2-yl]methyl]purine-2,6-dione
Names
[ CAS No. ]:
116763-38-3
[ 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