[(1R,5S)-5-(2-hydroxypropan-2-yl)-2-methylcyclohex-2-en-1-yl] 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetate

Names

[ Name ]:
[(1R,5S)-5-(2-hydroxypropan-2-yl)-2-methylcyclohex-2-en-1-yl] 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetate

[Synonym ]:
Theophylline-7-acetic acid ester of d,l-trans-sobrerol
CO/1488
7H-Purine-7-acetic acid,1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-,5-(1-hydroxy-1-methylethyl)-2-methyl-2-cyclohexen-1-yl ester,trans-(+-)

Chemical & Physical Properties

[ Density]:
1.36g/cm3

[ Boiling Point ]:
586.4ºC at 760 mmHg

[ Molecular Formula ]:
C₁₉H₂₆N₄O₅

[ Molecular Weight ]:
390.43400

[ Flash Point ]:
308.5ºC

[ Exact Mass ]:
390.19000

[ PSA ]:
108.35000

[ LogP ]:
0.47270

[ Vapour Pressure ]:
1.35E-14mmHg at 25°C

[ Index of Refraction ]:
1.628