About phenoxy(diphenyl)phosphane
phenoxy(diphenyl)phosphane (PubChem CID 11543680) has the molecular formula C18H15OP
and a molecular weight of 278.29 g/mol. Its IUPAC name is phenoxy(diphenyl)phosphane.
Molecular Properties
| Compound Name | phenoxy(diphenyl)phosphane |
| PubChem CID | 11543680 |
| Molecular Formula | C18H15OP |
| Molecular Weight | 278.29 g/mol |
| Exact Mass | 278.09 |
| IUPAC Name | phenoxy(diphenyl)phosphane |
| SMILES | c1ccc(OP(c2ccccc2)c2ccccc2)cc1 |
| InChI | InChI=1S/C18H15OP/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H |
| InChIKey | UPDNYUVJHQABBS-UHFFFAOYSA-N |
| XLogP | 4.11 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 278.29 |
| LogP ≤ 5 | 4.11 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of phenoxy(diphenyl)phosphane?
The IUPAC name of phenoxy(diphenyl)phosphane (CID 11543680) is phenoxy(diphenyl)phosphane.
What is the SMILES notation for phenoxy(diphenyl)phosphane?
The canonical SMILES for phenoxy(diphenyl)phosphane is c1ccc(OP(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of phenoxy(diphenyl)phosphane?
The InChIKey is UPDNYUVJHQABBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15OP/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H.
What are the key properties of phenoxy(diphenyl)phosphane?
phenoxy(diphenyl)phosphane has a molecular weight of 278.29 g/mol, XLogP of 4.11, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenoxy(diphenyl)phosphane is sourced from PubChem (CID 11543680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).