About pentyl(phosphanyl)phosphane
pentyl(phosphanyl)phosphane (PubChem CID 87351270) has the molecular formula C5H14P2
and a molecular weight of 136.12 g/mol. Its IUPAC name is pentyl(phosphanyl)phosphane.
Molecular Properties
| Compound Name | pentyl(phosphanyl)phosphane |
| PubChem CID | 87351270 |
| Molecular Formula | C5H14P2 |
| Molecular Weight | 136.12 g/mol |
| Exact Mass | 136.06 |
| IUPAC Name | pentyl(phosphanyl)phosphane |
| SMILES | CCCCCPP |
| InChI | InChI=1S/C5H14P2/c1-2-3-4-5-7-6/h7H,2-6H2,1H3 |
| InChIKey | KDPWYKLFFQKIDR-UHFFFAOYSA-N |
| XLogP | 2.65 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 7 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 136.12 |
| LogP ≤ 5 | 2.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of pentyl(phosphanyl)phosphane?
The IUPAC name of pentyl(phosphanyl)phosphane (CID 87351270) is pentyl(phosphanyl)phosphane.
What is the SMILES notation for pentyl(phosphanyl)phosphane?
The canonical SMILES for pentyl(phosphanyl)phosphane is CCCCCPP.
What is the InChIKey of pentyl(phosphanyl)phosphane?
The InChIKey is KDPWYKLFFQKIDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14P2/c1-2-3-4-5-7-6/h7H,2-6H2,1H3.
What are the key properties of pentyl(phosphanyl)phosphane?
pentyl(phosphanyl)phosphane has a molecular weight of 136.12 g/mol, XLogP of 2.65, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pentyl(phosphanyl)phosphane is sourced from PubChem (CID 87351270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).