| Melting point |
157-159°C |
| Boiling point |
583.5±33.0 °C(Predicted) |
| Density |
1.291±0.06 g/cm3(Predicted) |
| storage temp. |
Sealed in dry,2-8°C |
| solubility |
DMF (Slightly), DMSO (Slightly), Methanol (Slightly) |
| pka |
3.89±0.10(Predicted) |
| form |
Solid |
| color |
White |
| InChI |
InChI=1/C21H21NO4/c23-20(24)19(11-13-9-10-13)22-21(25)26-12-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,13,18-19H,9-12H2,(H,22,25)(H,23,24)/t19-/s3 |
| InChIKey |
DRGUEWQZLABTFG-DETXXQSHNA-N |
| SMILES |
C1(COC(=O)N[C@H](C(=O)O)CC2CC2)C2C=CC=CC=2C2C=CC=CC1=2 |&1:6,r| |
| CAS DataBase Reference |
214750-76-2(CAS DataBase Reference) |
