Chemical Properties
Boiling point | 607.9±55.0 °C(Predicted) |
Density | 1.37±0.1 g/cm3(Predicted) |
storage temp. | Store at -20°C |
solubility | DMSO:84.0(Max Conc. mg/mL);197.67(Max Conc. mM) Ethanol:17.0(Max Conc. mg/mL);40.01(Max Conc. mM) |
pka | 12.87±0.70(Predicted) |
form | Powder |
color | White to off-white |
InChIKey | QKDRXGFQVGOQKS-WFCPIQDQNA-N |
SMILES | [C@@H]1(C2=CC=C(Cl)C(CC3=CC=C(OCC)C=C3)=C2)O[C@H](SC)[C@@H](O)[C@H](O)[C@H]1O |&1:0,19,22,24,26,r| |