HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-(Butoxymethyl)-4-methoxybenzene
Identifiers & Physical Properties
| CAS No. | 5333-52-8 |
|---|---|
| Molecular formula | C12H18O2 |
| Average molar mass | 194.27 g/mol |
| Monoisotopic mass | 194.13067981 g/mol |
| SMILES | CCCCOCc1ccc(OC)cc1 |
| InChIKey | CWTASUFNGJFIMV-UHFFFAOYSA-N |
| PubChem CID | 220121 |
| DTXSID | DTXSID60277458 |
Chemical & Physical Properties
| XLogP | 2.8 |
|---|---|
| Topological polar surface area | 18.5 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 6 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 128 |