About benzyl(tributyl)silane
benzyl(tributyl)silane (PubChem CID 14614990) has the molecular formula C19H34Si
and a molecular weight of 290.57 g/mol. Its IUPAC name is benzyl(tributyl)silane.
Molecular Properties
| Compound Name | benzyl(tributyl)silane |
| PubChem CID | 14614990 |
| Molecular Formula | C19H34Si |
| Molecular Weight | 290.57 g/mol |
| Exact Mass | 290.24 |
| IUPAC Name | benzyl(tributyl)silane |
| SMILES | CCCC[Si](CCCC)(CCCC)Cc1ccccc1 |
| InChI | InChI=1S/C19H34Si/c1-4-7-15-20(16-8-5-2,17-9-6-3)18-19-13-11-10-12-14-19/h10-14H,4-9,15-18H2,1-3H3 |
| InChIKey | AMXCQWFZYZIEGG-UHFFFAOYSA-N |
| XLogP | 6.62 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 11 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 290.57 |
| LogP ≤ 5 | 6.62 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze benzyl(tributyl)silane with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of benzyl(tributyl)silane?
The IUPAC name of benzyl(tributyl)silane (CID 14614990) is benzyl(tributyl)silane.
What is the SMILES notation for benzyl(tributyl)silane?
The canonical SMILES for benzyl(tributyl)silane is CCCC[Si](CCCC)(CCCC)Cc1ccccc1.
What is the InChIKey of benzyl(tributyl)silane?
The InChIKey is AMXCQWFZYZIEGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34Si/c1-4-7-15-20(16-8-5-2,17-9-6-3)18-19-13-11-10-12-14-19/h10-14H,4-9,15-18H2,1-3H3.
What are the key properties of benzyl(tributyl)silane?
benzyl(tributyl)silane has a molecular weight of 290.57 g/mol, XLogP of 6.62, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl(tributyl)silane is sourced from PubChem (CID 14614990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).