HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Octyl-2,5-bis(1,4-naphthoquinon-2-yl)pyrrole

Identifiers & Physical Properties
| Molecular formula | C32H29NO4 |
|---|---|
| Average molar mass | 491.6 g/mol |
| SMILES | CCCCCCCCn1c(C2=CC(=O)c3ccccc3C2=O)ccc1C1=CC(=O)c2ccccc2C1=O |
| InChIKey | ABKXLGKRKBVUJX-UHFFFAOYSA-N |
| PubChem CID | 10696448 |
Chemical & Physical Properties
| XLogP | 6.4 |
|---|---|
| Topological polar surface area | 73.2 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 9 |
| Heavy atoms | 37 |
| Formal charge | 0 |
| Complexity | 907 |