HuagongsheHuagongshe Chemistry Print Report · For research reference only
Dimethyl (r)-malate o-triflate
Identifiers & Physical Properties
| CAS No. | 171049-36-8 |
|---|---|
| Molecular formula | C7H9F3O7S |
| Average molar mass | 294.2 g/mol |
| Monoisotopic mass | 294.00210828 g/mol |
| SMILES | COC(=O)C[C@@H](OS(=O)(=O)C(F)(F)F)C(=O)OC |
| InChIKey | VTGAHMHUTNTATF-SCSAIBSYSA-N |
| PubChem CID | 11033713 |
| DTXSID | DTXSID70452754 |
Chemical & Physical Properties
| XLogP | 0.6 |
|---|---|
| Topological polar surface area | 104 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 10 |
| Rotatable bonds | 7 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 408 |