About triphenyl-[(E)-2-phenylethenyl]phosphanium
triphenyl-[(E)-2-phenylethenyl]phosphanium (PubChem CID 6332815) has the molecular formula C26H22P+
and a molecular weight of 365.44 g/mol. Its IUPAC name is triphenyl-[(E)-2-phenylethenyl]phosphanium.
Molecular Properties
| Compound Name | triphenyl-[(E)-2-phenylethenyl]phosphanium |
| PubChem CID | 6332815 |
| Molecular Formula | C26H22P+ |
| Molecular Weight | 365.44 g/mol |
| Exact Mass | 365.15 |
| IUPAC Name | triphenyl-[(E)-2-phenylethenyl]phosphanium |
| SMILES | C(=C/[P+](c1ccccc1)(c1ccccc1)c1ccccc1)\c1ccccc1 |
| InChI | InChI=1S/C26H22P/c1-5-13-23(14-6-1)21-22-27(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-22H/q+1/b22-21+ |
| InChIKey | SLZOCLSYDVRSPN-QURGRASLSA-N |
| XLogP | 5.65 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 5 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 365.44 |
| LogP ≤ 5 | 5.65 |
| 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 triphenyl-[(E)-2-phenylethenyl]phosphanium?
The IUPAC name of triphenyl-[(E)-2-phenylethenyl]phosphanium (CID 6332815) is triphenyl-[(E)-2-phenylethenyl]phosphanium.
What is the SMILES notation for triphenyl-[(E)-2-phenylethenyl]phosphanium?
The canonical SMILES for triphenyl-[(E)-2-phenylethenyl]phosphanium is C(=C/[P+](c1ccccc1)(c1ccccc1)c1ccccc1)\c1ccccc1.
What is the InChIKey of triphenyl-[(E)-2-phenylethenyl]phosphanium?
The InChIKey is SLZOCLSYDVRSPN-QURGRASLSA-N. The full InChI is InChI=1S/C26H22P/c1-5-13-23(14-6-1)21-22-27(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-22H/q+1/b22-21+.
What are the key properties of triphenyl-[(E)-2-phenylethenyl]phosphanium?
triphenyl-[(E)-2-phenylethenyl]phosphanium has a molecular weight of 365.44 g/mol, XLogP of 5.65, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[(E)-2-phenylethenyl]phosphanium is sourced from PubChem (CID 6332815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).