| Melting point |
155-157 °C(lit.) |
| Boiling point |
457.1±30.0 °C(Predicted) |
| alpha |
-120° (c 1.0, CH2Cl2) |
| Density |
1.23±0.1 g/cm3(Predicted) |
| storage temp. |
Inert atmosphere,2-8°C |
| pka |
3.78±0.70(Predicted) |
| form |
crystal |
| color |
white |
| optical activity |
[α]25/D 118°, c = 0.7 in methylene chloride |
| BRN |
5824976 |
| InChI |
InChI=1S/C17H23N3O2/c1-10(2)14-8-21-16(19-14)12-6-5-7-13(18-12)17-20-15(9-22-17)11(3)4/h5-7,10-11,14-15H,8-9H2,1-4H3/t14-,15-/m1/s1 |
| InChIKey |
CSGQGLBCAHGJDR-HUUCEWRRSA-N |
| SMILES |
C1(C2=N[C@@H](C(C)C)CO2)=NC(C2=N[C@@H](C(C)C)CO2)=CC=C1 |
