HuagongsheHuagongshe Chemistry Print Report · For research reference only
[2,3,4,5-Tetraacetyloxy-6,6-bis(phenylmethoxy)hexyl] acetate
D-Galactose, bis(phenylmethyl) acetal, pentaacetate (9CI) · [3,4,5,6-tetraacetyloxy-1,1-bis(phenylmethoxy)hexan-2-yl] acetate
![[2,3,4,5-Tetraacetyloxy-6,6-bis(phenylmethoxy)hexyl] acetate molecular structure](/img/chemical/240297.png)
Identifiers & Physical Properties
| CAS No. | 4356-97-2 |
|---|---|
| Molecular formula | C30H36O12 |
| Average molar mass | 588.6 g/mol |
| Monoisotopic mass | 588.22067658 g/mol |
| SMILES | CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(OCc1ccccc1)OCc1ccccc1 |
| InChIKey | BXUMPCPEVFVVPT-UHFFFAOYSA-N |
| PubChem CID | 240297 |
| DTXSID | DTXSID60286540 |
Chemical & Physical Properties
| XLogP | 2.8 |
|---|---|
| Topological polar surface area | 150 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 12 |
| Rotatable bonds | 21 |
| Heavy atoms | 42 |
| Formal charge | 0 |
| Complexity | 856 |
| Melting point | 79-81 °C |
| Boiling point | 626.874±55.00 °C(Press: 760.00 Torr)(predicted) |
| Density | 1.229±0.06 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted) |