Melting point |
98-102°C |
Boiling point |
641.0±65.0 °C(Predicted) |
Density |
1.35±0.1 g/cm3(Predicted) |
storage temp. |
Keep in dark place,Inert atmosphere,Store in freezer, under -20°C |
solubility |
ethanol: soluble50mg/mL |
pka |
4.16±0.10(Predicted) |
form |
solid |
color |
White to Off-White |
biological source |
synthetic |
Merck |
14,151 |
InChI |
InChI=1S/C20H32N5O7P/c1-19(2,3)17(26)29-11-31-33(32-12-30-18(27)20(4,5)6)13-28-8-7-25-10-24-14-15(21)22-9-23-16(14)25/h9-10H,7-8,11-13H2,1-6H3,(H2,21,22,23) |
InChIKey |
WOZSCQDILHKSGG-UHFFFAOYSA-N |
SMILES |
P(OCOC(=O)C(C)(C)C)(OCOC(=O)C(C)(C)C)COCCN1C2C(N=C1)=C(N)N=CN=2 |
CAS DataBase Reference |
142340-99-6(CAS DataBase Reference) |