About tributyl(1-cyclopentylethoxy)silane
tributyl(1-cyclopentylethoxy)silane (PubChem CID 568687) has the molecular formula C19H40OSi
and a molecular weight of 312.61 g/mol. Its IUPAC name is tributyl(1-cyclopentylethoxy)silane.
Molecular Properties
| Compound Name | tributyl(1-cyclopentylethoxy)silane |
| PubChem CID | 568687 |
| Molecular Formula | C19H40OSi |
| Molecular Weight | 312.61 g/mol |
| Exact Mass | 312.28 |
| IUPAC Name | tributyl(1-cyclopentylethoxy)silane |
| SMILES | CCCC[Si](CCCC)(CCCC)OC(C)C1CCCC1 |
| InChI | InChI=1S/C19H40OSi/c1-5-8-15-21(16-9-6-2,17-10-7-3)20-18(4)19-13-11-12-14-19/h18-19H,5-17H2,1-4H3 |
| InChIKey | ZONYJYRPLRWBFL-UHFFFAOYSA-N |
| XLogP | 6.93 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 312.61 |
| LogP ≤ 5 | 6.93 |
| 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 tributyl(1-cyclopentylethoxy)silane?
The IUPAC name of tributyl(1-cyclopentylethoxy)silane (CID 568687) is tributyl(1-cyclopentylethoxy)silane.
What is the SMILES notation for tributyl(1-cyclopentylethoxy)silane?
The canonical SMILES for tributyl(1-cyclopentylethoxy)silane is CCCC[Si](CCCC)(CCCC)OC(C)C1CCCC1.
What is the InChIKey of tributyl(1-cyclopentylethoxy)silane?
The InChIKey is ZONYJYRPLRWBFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40OSi/c1-5-8-15-21(16-9-6-2,17-10-7-3)20-18(4)19-13-11-12-14-19/h18-19H,5-17H2,1-4H3.
What are the key properties of tributyl(1-cyclopentylethoxy)silane?
tributyl(1-cyclopentylethoxy)silane has a molecular weight of 312.61 g/mol, XLogP of 6.93, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(1-cyclopentylethoxy)silane is sourced from PubChem (CID 568687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).