| Melting point |
135° |
| alpha |
D20 +311° (c = 0.8 in alc) |
| Boiling point |
499.57°C (rough estimate) |
| Density |
1.1771 (rough estimate) |
| refractive index |
1.5614 (estimate) |
| storage temp. |
2-8°C(protect from light) |
| solubility |
Chloroform (Slightly), Methanol (Slightly, Sonicated) |
| form |
Solid |
| pka |
6.57±0.40(Predicted) |
| color |
White to Off-White |
| InChI |
InChI=1S/C22H27NO4/c1-13-15-6-7-18(24-2)22(27-5)17(15)12-23-9-8-14-10-19(25-3)20(26-4)11-16(14)21(13)23/h6-7,10-11,13,21H,8-9,12H2,1-5H3/t13-,21+/m0/s1 |
| InChIKey |
VRSRXLJTYQVOHC-YEJXKQKISA-N |
| SMILES |
C12=CC(OC)=C(OC)C=C1CCN1[C@]2([H])[C@@H](C)C2=CC=C(OC)C(OC)=C2C1 |
