HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Ethoxypentane
Pentane, 3-ethoxy- · 3-Ethoxypentane
Identifiers & Physical Properties
| CAS No. | 36749-13-0 |
|---|---|
| Molecular formula | C7H16O |
| Average molar mass | 116.2 g/mol |
| Monoisotopic mass | 116.12011513 g/mol |
| SMILES | CCOC(CC)CC |
| InChIKey | BMAINLNHNVARHJ-UHFFFAOYSA-N |
| PubChem CID | 37521 |
| DTXSID | DTXSID90190207 |
Chemical & Physical Properties
| XLogP | 2.3 |
|---|---|
| Topological polar surface area | 9.2 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 4 |
| Heavy atoms | 8 |
| Formal charge | 0 |
| Complexity | 39.7 |
| Melting point | -95.35°C (estimate) |
| Boiling point | 117.3°C (estimate) |
| Density | 0.7684 (estimate) |
| Refractive index | 1.3897 (estimate) |