IUPAC Name :2-amino-1H-pteridin-4-one
InChI :InChI=1/C6H5N5O/c7-6-10-4-3(5(12)11-6)8-1-2-9-4/h1-2H,(H3,7,9,10,11,12)
Std.InChI: InChI=1S/C6H5N5O/c7-6-10-4-3(5(12)11-6)8-1-2-9-4/h1-2H,(H3,7,9,10,11,12)
InChIKey :HNXQXTQTPAJEJL-UHFFFAOYAD
Std.InChIKey: HNXQXTQTPAJEJL-UHFFFAOYSA-N
SMILES :C1=CN=C2C(=N1)C(=O)N=C(N2)N
MDL: MFCD00010557
Molar Refractivity :40.07 ± 0.5 cm3 (est)
Parachor :268.2 ± 8.0 cm3 (est)
Index of Refraction :1.917 ± 0.05
(est)
Surface Tension :99.3 ± 7.0 dyne/cm (est)
Density :1.91 ± 0.1 g/cm3 (est)
Polarizability :15.88 ± 0.5 10-24cm3 (est)