About diethyl(propyl)phosphane
diethyl(propyl)phosphane (PubChem CID 19828866) has the molecular formula C7H17P
and a molecular weight of 132.19 g/mol. Its IUPAC name is diethyl(propyl)phosphane.
Molecular Properties
| Compound Name | diethyl(propyl)phosphane |
| PubChem CID | 19828866 |
| Molecular Formula | C7H17P |
| Molecular Weight | 132.19 g/mol |
| Exact Mass | 132.11 |
| IUPAC Name | diethyl(propyl)phosphane |
| SMILES | CCCP(CC)CC |
| InChI | InChI=1S/C7H17P/c1-4-7-8(5-2)6-3/h4-7H2,1-3H3 |
| InChIKey | SHCATAMMUJGPTD-UHFFFAOYSA-N |
| XLogP | 2.92 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 132.19 |
| LogP ≤ 5 | 2.92 |
| 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 diethyl(propyl)phosphane?
The IUPAC name of diethyl(propyl)phosphane (CID 19828866) is diethyl(propyl)phosphane.
What is the SMILES notation for diethyl(propyl)phosphane?
The canonical SMILES for diethyl(propyl)phosphane is CCCP(CC)CC.
What is the InChIKey of diethyl(propyl)phosphane?
The InChIKey is SHCATAMMUJGPTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17P/c1-4-7-8(5-2)6-3/h4-7H2,1-3H3.
What are the key properties of diethyl(propyl)phosphane?
diethyl(propyl)phosphane has a molecular weight of 132.19 g/mol, XLogP of 2.92, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl(propyl)phosphane is sourced from PubChem (CID 19828866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).