HuagongsheHuagongshe Chemistry Print Report · For research reference only
5,5'-Disulfanediylbis(2,3-dimethoxynaphthalene-1,4-dione)
Identifiers & Physical Properties
| CAS No. | 89226-92-6 |
|---|---|
| Molecular formula | C24H18O8S2 |
| Average molar mass | 498.5 g/mol |
| Monoisotopic mass | 498.04430988 g/mol |
| SMILES | COC1=C(OC)C(=O)c2c(SSc3cccc4c3C(=O)C(OC)=C(OC)C4=O)cccc2C1=O |
| InChIKey | CTHHKSDZFLGZLA-UHFFFAOYSA-N |
| PubChem CID | 13375673 |
| DTXSID | DTXSID90538660 |
Chemical & Physical Properties
| XLogP | 3.8 |
|---|---|
| Topological polar surface area | 156 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 10 |
| Rotatable bonds | 7 |
| Heavy atoms | 34 |
| Formal charge | 0 |
| Complexity | 879 |