| Boiling point |
743.2±60.0 °C(Predicted) |
| Density |
1.54±0.1 g/cm3(Predicted) |
| storage temp. |
Hygroscopic, -20°C Freezer, Under inert atmosphere |
| solubility |
DMSO (Slightly), Water (Slightly, Heated, Sonicated) |
| pka |
2.44±0.50(Predicted) |
| form |
Solid |
| color |
White to Off-White |
| InChI |
1S/C16H19N3O5S/c1-16(2)11(15(23)24)19-13(22)10(14(19)25-16)18-12(21)9(17)7-3-5-8(20)6-4-7/h3-6,9-11,14,20H,17H2,1-2H3,(H,18,21)(H,23,24)/t9-,10+,11-,14+/m0/s1 |
| InChIKey |
LSQZJLSUYDQPKJ-BBGACYKPSA-N |
| SMILES |
S1[C@H]2N([C@H](C1(C)C)C(=O)[O-])C(=O)[C@H]2NC(=O)[C@@H]([N+H3])c3ccc(cc3)O |
