About cyclododecyl(cyclopropyl)phosphane
cyclododecyl(cyclopropyl)phosphane (PubChem CID 69425218) has the molecular formula C15H29P
and a molecular weight of 240.37 g/mol. Its IUPAC name is cyclododecyl(cyclopropyl)phosphane.
Molecular Properties
| Compound Name | cyclododecyl(cyclopropyl)phosphane |
| PubChem CID | 69425218 |
| Molecular Formula | C15H29P |
| Molecular Weight | 240.37 g/mol |
| Exact Mass | 240.20 |
| IUPAC Name | cyclododecyl(cyclopropyl)phosphane |
| SMILES | C1CCCCCC(PC2CC2)CCCCC1 |
| InChI | InChI=1S/C15H29P/c1-2-4-6-8-10-14(16-15-12-13-15)11-9-7-5-3-1/h14-16H,1-13H2 |
| InChIKey | SPVAHXUEYDTAPY-UHFFFAOYSA-N |
| XLogP | 5.50 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 240.37 |
| LogP ≤ 5 | 5.50 |
| 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 cyclododecyl(cyclopropyl)phosphane?
The IUPAC name of cyclododecyl(cyclopropyl)phosphane (CID 69425218) is cyclododecyl(cyclopropyl)phosphane.
What is the SMILES notation for cyclododecyl(cyclopropyl)phosphane?
The canonical SMILES for cyclododecyl(cyclopropyl)phosphane is C1CCCCCC(PC2CC2)CCCCC1.
What is the InChIKey of cyclododecyl(cyclopropyl)phosphane?
The InChIKey is SPVAHXUEYDTAPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29P/c1-2-4-6-8-10-14(16-15-12-13-15)11-9-7-5-3-1/h14-16H,1-13H2.
What are the key properties of cyclododecyl(cyclopropyl)phosphane?
cyclododecyl(cyclopropyl)phosphane has a molecular weight of 240.37 g/mol, XLogP of 5.50, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclododecyl(cyclopropyl)phosphane is sourced from PubChem (CID 69425218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).