Melting point |
222 °C |
Density |
1.641±0.06 g/cm3(Predicted) |
storage temp. |
Inert atmosphere,Room Temperature |
solubility |
Methanol (Very Slightly, Heated), Water (Slightly, Sonicated, Heated) |
pka |
8.52±0.10(Predicted) |
form |
Solid |
color |
White to Off-White |
PH |
~9.0 |
λmax |
264nm(MeOH)(lit.) |
InChI |
InChI=1/C9H12N2O6/c12-2-4-5(13)6(14)7(17-4)3-1-10-9(16)11-8(3)15/h1,4-7,12-14H,2H2,(H2,10,11,15,16)/t4-,5-,6-,7+/s3 |
InChIKey |
PTJWIQPHWPFNBW-IZFRNLNUNA-N |
SMILES |
O[C@@H]1[C@@H]([C@@H](CO)O[C@H]1C1=CNC(=O)NC1=O)O |&1:1,2,3,7,r| |