IUPAC Name :7,9-dihydro-3H-purine-2,6,8-trione
InChI :InChI=1/C5H4N4O3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)
Std.InChI: InChI=1S/C5H4N4O3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)
InChIKey :LEHOTFFKMJEONL-UHFFFAOYAN
Std.InChIKey: LEHOTFFKMJEONL-UHFFFAOYSA-N
SMILES :C12=C(NC(=N1)O)N=C(N=C2O)O
MDL: MFCD00005712
Molar Refractivity :38.44 ± 0.3 cm3 (est)
Parachor :298.1 ± 4.0 cm3 (est)
Index of Refraction :2.001 ± 0.02
(est)
Surface Tension :226.8 ± 3.0 dyne/cm (est)
Density :2.188 ± 0.06 g/cm3 (est)
Polarizability :15.24 ± 0.5 10-24cm3 (est)