| Melting point |
100 °C |
| Boiling point |
539.7±50.0 °C(Predicted) |
| Density |
1.39±0.1 g/cm3(Predicted) |
| storage temp. |
2-8°C |
| solubility |
methanol: 50 mg/mL, clear, colorless |
| pka |
12.99±0.70(Predicted) |
| form |
Solid |
| color |
White to off-white |
| optical activity |
[α]/D -33.00 to -27.00°, c =9.00-11.00 mg/mL in methanol |
| BRN |
20033 |
| InChI |
InChI=1/C14H20O5S/c15-8-10-11(16)12(17)13(18)14(20-10)19-7-6-9-4-2-1-3-5-9/h1-5,10-18H,6-8H2/t10-,11+,12+,13-,14-/s3 |
| InChIKey |
RXWGJLGIKBAPBK-YEDZMODINA-N |
| SMILES |
[C@H]1(OCCC2C=CC=CC=2)[C@H](O)[C@H]([C@@H](O)[C@@H](CO)S1)O |&1:0,10,12,13,15,r| |
