Chemical Properties
| Density | 1.827±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) |
| storage temp. | Store at -20°C |
| solubility | DMSO: 125 mg/mL (379.74 mM) |
| pka | 7.686±0.20(predicted) |
| form | Solid |
| color | Light yellow to orange |
| InChI | 1S/C11H9BrN2O3S/c1-17-8-4-6(12)2-5(9(8)15)3-7-10(16)14-11(18)13-7/h2-4,15H,1H3,(H2,13,14,16,18) |
| InChIKey | PYLYAEDUIKQBOT-UHFFFAOYSA-N |
| SMILES | COC1=CC(=CC(=C1O)C=C2C(=O)NC(=S)N2)Br |
