| Melting point |
211-212 °C |
| Boiling point |
695.3±65.0 °C(Predicted) |
| Density |
1.88±0.1 g/cm3(Predicted) |
| storage temp. |
Store at -20°C |
| solubility |
DMSO : 20.83 mg/mL (73.80 mM; Need ultrasonic) |
| form |
A solid |
| pka |
13.22±0.70(Predicted) |
| color |
White to off-white |
| λmax |
249 (pH 6) |
| InChI |
InChI=1/C11H16N4O5/c1-14-3-13-9-6(10(14)19)12-4-15(9)11-8(18)7(17)5(2-16)20-11/h4-5,7-8,11,16-19H,2-3H2,1H3/t5-,7-,8-,11-/s3 |
| InChIKey |
QCTGLUIBIHRABQ-ABFAXUGDNA-N |
| SMILES |
OC[C@H]1O[C@@H](N2C3C(=C(N(C)CN=3)O)N=C2)[C@H](O)[C@@H]1O |&1:2,4,16,18,r| |
