About (R)-hexan-2-yl-methyl-propylphosphane
(R)-hexan-2-yl-methyl-propylphosphane (PubChem CID 88871089) has the molecular formula C10H23P
and a molecular weight of 174.27 g/mol. Its IUPAC name is (R)-hexan-2-yl-methyl-propylphosphane.
Molecular Properties
| Compound Name | (R)-hexan-2-yl-methyl-propylphosphane |
| PubChem CID | 88871089 |
| Molecular Formula | C10H23P |
| Molecular Weight | 174.27 g/mol |
| Exact Mass | 174.15 |
| IUPAC Name | (R)-hexan-2-yl-methyl-propylphosphane |
| SMILES | CCCCC(C)[P@](C)CCC |
| InChI | InChI=1S/C10H23P/c1-5-7-8-10(3)11(4)9-6-2/h10H,5-9H2,1-4H3/t10?,11-/m1/s1 |
| InChIKey | WSQYDSQFUMMSOY-RRKGBCIJSA-N |
| XLogP | 4.09 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 6 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 174.27 |
| LogP ≤ 5 | 4.09 |
| 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 (R)-hexan-2-yl-methyl-propylphosphane?
The IUPAC name of (R)-hexan-2-yl-methyl-propylphosphane (CID 88871089) is (R)-hexan-2-yl-methyl-propylphosphane.
What is the SMILES notation for (R)-hexan-2-yl-methyl-propylphosphane?
The canonical SMILES for (R)-hexan-2-yl-methyl-propylphosphane is CCCCC(C)[P@](C)CCC.
What is the InChIKey of (R)-hexan-2-yl-methyl-propylphosphane?
The InChIKey is WSQYDSQFUMMSOY-RRKGBCIJSA-N. The full InChI is InChI=1S/C10H23P/c1-5-7-8-10(3)11(4)9-6-2/h10H,5-9H2,1-4H3/t10?,11-/m1/s1.
What are the key properties of (R)-hexan-2-yl-methyl-propylphosphane?
(R)-hexan-2-yl-methyl-propylphosphane has a molecular weight of 174.27 g/mol, XLogP of 4.09, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-hexan-2-yl-methyl-propylphosphane is sourced from PubChem (CID 88871089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).