| Melting point |
251-255℃ |
| Boiling point |
717℃ |
| Density |
1.1931 (rough estimate) |
| refractive index |
1.7000 (estimate) |
| Flash point |
>110°(230°F) |
| storage temp. |
Amber Vial, -20°C Freezer, Under inert atmosphere |
| solubility |
1 M NaOH: soluble50mg/mL |
| pka |
4.14±0.20(Predicted) |
| form |
Powder |
| color |
White to off-white |
| Water Solubility |
Soluble in 1N sodium hydroxide or in DMSO. Insoluble in water |
| Sensitive |
Light Sensitive |
| InChI |
InChI=1S/C14H17N5O3/c1-2-18-8-10(13(21)22)11(20)9-7-16-14(17-12(9)18)19-5-3-15-4-6-19/h7-8,15H,2-6H2,1H3,(H,21,22) |
| InChIKey |
JOHZPMXAZQZXHR-UHFFFAOYSA-N |
| SMILES |
C1(N2CCNCC2)=NC=C2C(=O)C(C(O)=O)=CN(CC)C2=N1 |
| CAS DataBase Reference |
51940-44-4(CAS DataBase Reference) |
