| Melting point |
>56°C (dec.) |
| Boiling point |
553.2±50.0 °C(Predicted) |
| Density |
1.322±0.06 g/cm3(Predicted) |
| storage temp. |
-20°C Freezer |
| solubility |
Acetone (Slightly), Chloroform (Slightly), Methanol (Slightly) |
| pka |
2.83±0.20(Predicted) |
| form |
Solid |
| color |
White to Pale Yellow |
| Major Application |
pharmaceutical small molecule |
| InChI |
InChI=1S/C22H22Cl2N2O2/c1-2-28-22(27)26-11-8-14(9-12-26)20-17-6-4-16(23)13-15(17)3-5-18-19(24)7-10-25-21(18)20/h4,6-7,10,13H,2-3,5,8-9,11-12H2,1H3 |
| InChIKey |
LOTMYBFPXGPIDD-UHFFFAOYSA-N |
| SMILES |
N1(C(OCC)=O)CC/C(=C2\C3=NC=CC(Cl)=C3CCC3=CC(Cl)=CC=C3\2)/CC1 |
