| Melting point |
100 °C |
| Boiling point |
487.7±25.0 °C(Predicted) |
| Density |
1.31±0.1 g/cm3(Predicted) |
| storage temp. |
Sealed in dry,Room Temperature |
| solubility |
Practically insoluble in water, freely soluble in methylene chloride, soluble in acetone, slightly soluble in alcohol. |
| form |
Solid |
| pka |
2.44±0.34(Predicted) |
| color |
White to Off-White |
| Major Application |
pharmaceutical
pharmaceutical small molecule |
| InChI |
InChI=1S/C13H13N3O4/c1-10-14-9-12(16(18)19)15(10)7-8-20-13(17)11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3 |
| InChIKey |
CUUCCLJJOWSASK-UHFFFAOYSA-N |
| SMILES |
N1(CCOC(=O)C2C=CC=CC=2)C(C)=NC=C1[N+]([O-])=O |
| CAS DataBase Reference |
13182-89-3(CAS DataBase Reference) |
| FDA UNII |
A355C835XC |
| UNSPSC Code |
41116107 |
| NACRES |
NA.24 |
