About [diphenyl(phosphanyl)methyl]phosphane
[diphenyl(phosphanyl)methyl]phosphane (PubChem CID 23002363) has the molecular formula C13H14P2
and a molecular weight of 232.20 g/mol. Its IUPAC name is [diphenyl(phosphanyl)methyl]phosphane.
Molecular Properties
| Compound Name | [diphenyl(phosphanyl)methyl]phosphane |
| PubChem CID | 23002363 |
| Molecular Formula | C13H14P2 |
| Molecular Weight | 232.20 g/mol |
| Exact Mass | 232.06 |
| IUPAC Name | [diphenyl(phosphanyl)methyl]phosphane |
| SMILES | PC(P)(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C13H14P2/c14-13(15,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,14-15H2 |
| InChIKey | XGNLUPXBIFJGFS-UHFFFAOYSA-N |
| XLogP | 3.64 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 232.20 |
| LogP ≤ 5 | 3.64 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [diphenyl(phosphanyl)methyl]phosphane?
The IUPAC name of [diphenyl(phosphanyl)methyl]phosphane (CID 23002363) is [diphenyl(phosphanyl)methyl]phosphane.
What is the SMILES notation for [diphenyl(phosphanyl)methyl]phosphane?
The canonical SMILES for [diphenyl(phosphanyl)methyl]phosphane is PC(P)(c1ccccc1)c1ccccc1.
What is the InChIKey of [diphenyl(phosphanyl)methyl]phosphane?
The InChIKey is XGNLUPXBIFJGFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14P2/c14-13(15,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,14-15H2.
What are the key properties of [diphenyl(phosphanyl)methyl]phosphane?
[diphenyl(phosphanyl)methyl]phosphane has a molecular weight of 232.20 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [diphenyl(phosphanyl)methyl]phosphane is sourced from PubChem (CID 23002363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).