About cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane
cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane (PubChem CID 173167887) has the molecular formula C20H35P
and a molecular weight of 306.50 g/mol. Its IUPAC name is cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane.
Molecular Properties
| Compound Name | cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane |
| PubChem CID | 173167887 |
| Molecular Formula | C20H35P |
| Molecular Weight | 306.50 g/mol |
| Exact Mass | 306.25 |
| IUPAC Name | cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane |
| SMILES | C1CCCCC(=CCCC1)P/C/2=C/CCCCCCCC2 |
| InChI | InChI=1S/C20H35P/c1-3-7-11-15-19(16-12-8-4-1)21-20-17-13-9-5-2-6-10-14-18-20/h15,17,21H,1-14,16,18H2/b19-15+,20-17? |
| InChIKey | WMHMTNBSLXKBJN-AMOGWUEISA-N |
| XLogP | 7.50 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 21 |
| Complexity | 295 |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 306.50 |
| LogP ≤ 5 | 7.50 |
| 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 cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane?
The IUPAC name of cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane (CID 173167887) is cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane.
What is the SMILES notation for cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane?
The canonical SMILES for cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane is C1CCCCC(=CCCC1)P/C/2=C/CCCCCCCC2.
What is the InChIKey of cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane?
The InChIKey is WMHMTNBSLXKBJN-AMOGWUEISA-N. The full InChI is InChI=1S/C20H35P/c1-3-7-11-15-19(16-12-8-4-1)21-20-17-13-9-5-2-6-10-14-18-20/h15,17,21H,1-14,16,18H2/b19-15+,20-17?.
What are the key properties of cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane?
cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane has a molecular weight of 306.50 g/mol, XLogP of 7.50, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclodecen-1-yl-[(1E)-cyclodecen-1-yl]phosphane is sourced from PubChem (CID 173167887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).