HuagongsheHuagongshe Chemistry Print Report · For research reference only
Diethyl (4-biphenylylmethyl)phosphonate
Diethyl (4-phenylbenzyl)phosphonate · DIETHYL (4-BIPHENYLYLMETHYL)PHOSPHONATE · 4-[(Diethoxyphosphoryl)methyl]-1,1'-biphenyl · Diethyl P-([1,1'-biphenyl]-4-ylmethyl)phosphonate · Phosphonic acid, P-([1,1'-biphenyl]-4-ylmethyl)-, diethyl ester
Identifiers & Physical Properties
| CAS No. | 30818-70-3 |
|---|---|
| Molecular formula | C17H21O3P |
| Average molar mass | 304.32 g/mol |
| Monoisotopic mass | 304.12283153 g/mol |
| SMILES | CCOP(=O)(Cc1ccc(-c2ccccc2)cc1)OCC |
| InChIKey | HWKCLILHNFWQFV-UHFFFAOYSA-N |
| PubChem CID | 520494 |
| DTXSID | DTXSID80334370 |
Chemical & Physical Properties
| XLogP | 3.3 |
|---|---|
| Topological polar surface area | 35.5 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 7 |
| Heavy atoms | 21 |
| Formal charge | 0 |
| Complexity | 321 |
| Melting point | 58-60°C |