IUPAC Name :3,7-dihydropurine-2,6-dione
InChI :InChI=1/C5H4N4O2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)
Std.InChI: InChI=1S/C5H4N4O2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)
InChIKey :LRFVTYWOQMYALW-UHFFFAOYAT
Std.InChIKey: LRFVTYWOQMYALW-UHFFFAOYSA-N
SMILES :C1=NC2=C(N1)C(=O)NC(=O)N2
MDL: MFCD00078453
Molar Refractivity :36.56 ± 0.3 cm3 (est)
Parachor :283.1 ± 4.0 cm3 (est)
Index of Refraction :1.903 ± 0.02
(est)
Surface Tension :170.1 ± 3.0 dyne/cm (est)
Density :1.940 ± 0.06 g/cm3 (est)
Polarizability :14.49 ± 0.5 10-24cm3 (est)