About benzylsilane
benzylsilane (PubChem CID 4155767) has the molecular formula C7H10Si
and a molecular weight of 122.24 g/mol. Its IUPAC name is benzylsilane.
Molecular Properties
| Compound Name | benzylsilane |
| PubChem CID | 4155767 |
| Molecular Formula | C7H10Si |
| Molecular Weight | 122.24 g/mol |
| Exact Mass | 122.06 |
| IUPAC Name | benzylsilane |
| SMILES | [SiH3]Cc1ccccc1 |
| InChI | InChI=1S/C7H10Si/c8-6-7-4-2-1-3-5-7/h1-5H,6H2,8H3 |
| InChIKey | UWAXDPWQPGZNIO-UHFFFAOYSA-N |
| XLogP | 0.55 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 122.24 |
| LogP ≤ 5 | 0.55 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 benzylsilane?
The IUPAC name of benzylsilane (CID 4155767) is benzylsilane.
What is the SMILES notation for benzylsilane?
The canonical SMILES for benzylsilane is [SiH3]Cc1ccccc1.
What is the InChIKey of benzylsilane?
The InChIKey is UWAXDPWQPGZNIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10Si/c8-6-7-4-2-1-3-5-7/h1-5H,6H2,8H3.
What are the key properties of benzylsilane?
benzylsilane has a molecular weight of 122.24 g/mol, XLogP of 0.55, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzylsilane is sourced from PubChem (CID 4155767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).