About (4-benzyl-5-phenylpentyl)phosphane
(4-benzyl-5-phenylpentyl)phosphane (PubChem CID 57129556) has the molecular formula C18H23P
and a molecular weight of 270.36 g/mol. Its IUPAC name is (4-benzyl-5-phenylpentyl)phosphane.
Molecular Properties
| Compound Name | (4-benzyl-5-phenylpentyl)phosphane |
| PubChem CID | 57129556 |
| Molecular Formula | C18H23P |
| Molecular Weight | 270.36 g/mol |
| Exact Mass | 270.15 |
| IUPAC Name | (4-benzyl-5-phenylpentyl)phosphane |
| SMILES | PCCCC(Cc1ccccc1)Cc1ccccc1 |
| InChI | InChI=1S/C18H23P/c19-13-7-12-18(14-16-8-3-1-4-9-16)15-17-10-5-2-6-11-17/h1-6,8-11,18H,7,12-15,19H2 |
| InChIKey | LQKFDEGNPXUHNI-UHFFFAOYSA-N |
| XLogP | 4.74 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 7 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 270.36 |
| LogP ≤ 5 | 4.74 |
| 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 (4-benzyl-5-phenylpentyl)phosphane?
The IUPAC name of (4-benzyl-5-phenylpentyl)phosphane (CID 57129556) is (4-benzyl-5-phenylpentyl)phosphane.
What is the SMILES notation for (4-benzyl-5-phenylpentyl)phosphane?
The canonical SMILES for (4-benzyl-5-phenylpentyl)phosphane is PCCCC(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of (4-benzyl-5-phenylpentyl)phosphane?
The InChIKey is LQKFDEGNPXUHNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23P/c19-13-7-12-18(14-16-8-3-1-4-9-16)15-17-10-5-2-6-11-17/h1-6,8-11,18H,7,12-15,19H2.
What are the key properties of (4-benzyl-5-phenylpentyl)phosphane?
(4-benzyl-5-phenylpentyl)phosphane has a molecular weight of 270.36 g/mol, XLogP of 4.74, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-benzyl-5-phenylpentyl)phosphane is sourced from PubChem (CID 57129556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).