InChIKey | VIQVOCMJHFBVFN-UHFFFAOYSA-N |
---|---|
Inchi | 1S/C17H12ClN5/c18-13-8-6-11(7-9-13)14-10-15(12-4-2-1-3-5-12)23-17(20-14)21-16(19)22-23/h1-10H,(H2,19,22) |
SMILES | NC1N=C2N=C(C3C=CC(=CC=3)Cl)C=C(C3C=CC=CC=3)N2N=1 |
熔点 | 220-221 °C(Solvent: Dimethylformamide; Ethanol) |
---|---|
酸度系数(pKa) | 2.56±0.30(predicted) |
密度 | 1.44±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted) |