1H-Purine-2,6-dione,3,7-dihydro-8-(isothiocyanatomethyl)-1,3-dimethyl-7-(phenylmethyl)-

Names

[ Name ]:
1H-Purine-2,6-dione,3,7-dihydro-8-(isothiocyanatomethyl)-1,3-dimethyl-7-(phenylmethyl)-

[Synonym ]:
7-benzyl-8-(isothiocyanatomethyl)-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione
8-Isothiocyanatomethyl-7-benzyltheophyllin
7-benzyl-8-isothiocyanatomethyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione

Chemical & Physical Properties

[ Density]:
1.37g/cm3

[ Boiling Point ]:
556.4ºC at 760mmHg

[ Molecular Formula ]:
C₁₆H₁₅N₅O₂S

[ Molecular Weight ]:
341.38800

[ Flash Point ]:
290.3ºC

[ Exact Mass ]:
341.09500

[ PSA ]:
106.27000

[ LogP ]:
1.08480

[ Vapour Pressure ]:
2.04E-12mmHg at 25°C

[ Index of Refraction ]:
1.694