| Boiling point |
605.9±55.0 °C(Predicted) |
| Density |
1.068±0.06 g/cm3(Predicted) |
| refractive index |
nD25 1.5402 |
| storage temp. |
Store at -20°C |
| solubility |
DMSO: 100 mg/mL (206.34 mM) |
| form |
White to off-white solid. |
| pka |
8.96±0.50(Predicted) |
| color |
White to off-white |
| InChI |
1S/C28H40N2O5.ClH/c1-20(2)28(19-29,22-17-25(33-6)27(35-8)26(18-22)34-7)13-9-14-30(3)15-12-21-10-11-23(31-4)24(16-21)32-5;/h10-11,16-18,20H,9,12-15H2,1-8H3;1H |
| InChIKey |
OKCRIUNHEQSXFD-UHFFFAOYSA-N |
| SMILES |
Cl[H].COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2cc(OC)c(OC)c(OC)c2)cc1OC |
