HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-But-2-ynoxy-6-(3-fluoro-3-methylbutan-2-yl)oxypyrimidine
Identifiers & Physical Properties
| Molecular formula | C13H17FN2O2 |
|---|---|
| Average molar mass | 252.28 g/mol |
| Monoisotopic mass | 252.12740595 g/mol |
| SMILES | CC#CCOc1cc(OC(C)C(C)(C)F)ncn1 |
| InChIKey | HZRGKMKQFFXVBP-UHFFFAOYSA-N |
| PubChem CID | 17979110 |
Chemical & Physical Properties
| XLogP | 2.8 |
|---|---|
| Topological polar surface area | 44.2 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 5 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 321 |