About cyclononyl(ethyl)phosphane
cyclononyl(ethyl)phosphane (PubChem CID 69425111) has the molecular formula C11H23P
and a molecular weight of 186.28 g/mol. Its IUPAC name is cyclononyl(ethyl)phosphane.
Molecular Properties
| Compound Name | cyclononyl(ethyl)phosphane |
| PubChem CID | 69425111 |
| Molecular Formula | C11H23P |
| Molecular Weight | 186.28 g/mol |
| Exact Mass | 186.15 |
| IUPAC Name | cyclononyl(ethyl)phosphane |
| SMILES | CCPC1CCCCCCCC1 |
| InChI | InChI=1S/C11H23P/c1-2-12-11-9-7-5-3-4-6-8-10-11/h11-12H,2-10H2,1H3 |
| InChIKey | ALGCQGNGCMOWTA-UHFFFAOYSA-N |
| XLogP | 4.19 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 186.28 |
| LogP ≤ 5 | 4.19 |
| 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 cyclononyl(ethyl)phosphane?
The IUPAC name of cyclononyl(ethyl)phosphane (CID 69425111) is cyclononyl(ethyl)phosphane.
What is the SMILES notation for cyclononyl(ethyl)phosphane?
The canonical SMILES for cyclononyl(ethyl)phosphane is CCPC1CCCCCCCC1.
What is the InChIKey of cyclononyl(ethyl)phosphane?
The InChIKey is ALGCQGNGCMOWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23P/c1-2-12-11-9-7-5-3-4-6-8-10-11/h11-12H,2-10H2,1H3.
What are the key properties of cyclononyl(ethyl)phosphane?
cyclononyl(ethyl)phosphane has a molecular weight of 186.28 g/mol, XLogP of 4.19, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclononyl(ethyl)phosphane is sourced from PubChem (CID 69425111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).