About bis(2-phenylpropyl)-silyloxysilane
bis(2-phenylpropyl)-silyloxysilane (PubChem CID 123454947) has the molecular formula C18H26OSi2
and a molecular weight of 314.58 g/mol. Its IUPAC name is bis(2-phenylpropyl)-silyloxysilane.
Molecular Properties
| Compound Name | bis(2-phenylpropyl)-silyloxysilane |
| PubChem CID | 123454947 |
| Molecular Formula | C18H26OSi2 |
| Molecular Weight | 314.58 g/mol |
| Exact Mass | 314.15 |
| IUPAC Name | bis(2-phenylpropyl)-silyloxysilane |
| SMILES | CC(C[SiH](CC(C)c1ccccc1)O[SiH3])c1ccccc1 |
| InChI | InChI=1S/C18H26OSi2/c1-15(17-9-5-3-6-10-17)13-21(19-20)14-16(2)18-11-7-4-8-12-18/h3-12,15-16,21H,13-14H2,1-2,20H3 |
| InChIKey | VZRYGYQACBEXBT-UHFFFAOYSA-N |
| XLogP | 3.61 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 314.58 |
| LogP ≤ 5 | 3.61 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of bis(2-phenylpropyl)-silyloxysilane?
The IUPAC name of bis(2-phenylpropyl)-silyloxysilane (CID 123454947) is bis(2-phenylpropyl)-silyloxysilane.
What is the SMILES notation for bis(2-phenylpropyl)-silyloxysilane?
The canonical SMILES for bis(2-phenylpropyl)-silyloxysilane is CC(C[SiH](CC(C)c1ccccc1)O[SiH3])c1ccccc1.
What is the InChIKey of bis(2-phenylpropyl)-silyloxysilane?
The InChIKey is VZRYGYQACBEXBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26OSi2/c1-15(17-9-5-3-6-10-17)13-21(19-20)14-16(2)18-11-7-4-8-12-18/h3-12,15-16,21H,13-14H2,1-2,20H3.
What are the key properties of bis(2-phenylpropyl)-silyloxysilane?
bis(2-phenylpropyl)-silyloxysilane has a molecular weight of 314.58 g/mol, XLogP of 3.61, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-phenylpropyl)-silyloxysilane is sourced from PubChem (CID 123454947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).