HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Hexadecyloctahydro-1H-indene
1-Hexadecyloctahydro-1H-indene · 1H-Indene, 1-hexadecyloctahydro-
Identifiers & Physical Properties
| CAS No. | 55401-73-5 |
|---|---|
| Molecular formula | C25H48 |
| Average molar mass | 348.6 g/mol |
| Monoisotopic mass | 348.37560153 g/mol |
| SMILES | CCCCCCCCCCCCCCCCC1CCC2CCCCC12 |
| InChIKey | XYDNFNUIQWCNEV-UHFFFAOYSA-N |
| PubChem CID | 294708 |
| DTXSID | DTXSID20970751 |
Chemical & Physical Properties
| XLogP | 12.5 |
|---|---|
| Topological polar surface area | 0 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 0 |
| Rotatable bonds | 15 |
| Heavy atoms | 25 |
| Formal charge | 0 |
| Complexity | 294 |
| SpringerMaterials Properties | Boiling point |
| Melting point | 36.4 °C |
| Boiling point | 417.97°C (rough estimate) |
| Density | 0.9220 (rough estimate) |
| Refractive index | 1.5220 (estimate) |