| Melting point |
195 °C |
| Boiling point |
646.6±55.0 °C(Predicted) |
| alpha |
-34.5 º (c=1% in DMF/H2O 1:1) |
| Density |
1.824±0.06 g/cm3(Predicted) |
| storage temp. |
2-8°C |
| solubility |
DMF: soluble |
| form |
Powder |
| pka |
12.82±0.70(Predicted) |
| color |
White |
| optical activity |
[α]20/D 34.5±2.0°, c = 1% in DMF/H2O 1:1 |
| Water Solubility |
Soluble in dimethylformamide (100 mg/ml), dimethylformamide/water (1:1 v/v) (10 mg/ml - clear, practically colorless solution). |
| BRN |
1550140 |
| InChI |
1S/C14H16BrNO6/c15-6-1-2-8-7(3-6)9(4-16-8)21-14-13(20)12(19)11(18)10(5-17)22-14/h1-4,10-14,16-20H,5H2/t10-,11+,12+,13-,14-/m1/s1 |
| InChIKey |
LINMATFDVHBYOS-MBJXGIAVSA-N |
| SMILES |
OC[C@H]1O[C@@H](Oc2c[nH]c3ccc(Br)cc23)[C@H](O)[C@@H](O)[C@H]1O |
| CAS DataBase Reference |
97753-82-7(CAS DataBase Reference) |
