HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Phenylpropenenitrile, 2-(diethoxyphosphinyl)-
Identifiers & Physical Properties
| CAS No. | 18896-73-6 |
|---|---|
| Molecular formula | C13H16NO3P |
| Average molar mass | 265.24 g/mol |
| Monoisotopic mass | 265.08678037 g/mol |
| SMILES | CCOP(=O)(OCC)/C(C#N)=C\c1ccccc1 |
| InChIKey | SEZSXMSQCRWUAS-RAXLEYEMSA-N |
| PubChem CID | 5367708 |
Chemical & Physical Properties
| XLogP | 2.1 |
|---|---|
| Topological polar surface area | 59.3 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 6 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 367 |