About butyl-diethoxy-iodosilane
butyl-diethoxy-iodosilane (PubChem CID 154487050) has the molecular formula C8H19IO2Si
and a molecular weight of 302.23 g/mol. Its IUPAC name is butyl-diethoxy-iodosilane.
Molecular Properties
| Compound Name | butyl-diethoxy-iodosilane |
| PubChem CID | 154487050 |
| Molecular Formula | C8H19IO2Si |
| Molecular Weight | 302.23 g/mol |
| Exact Mass | 302.02 |
| IUPAC Name | butyl-diethoxy-iodosilane |
| SMILES | CCCC[Si](I)(OCC)OCC |
| InChI | InChI=1S/C8H19IO2Si/c1-4-7-8-12(9,10-5-2)11-6-3/h4-8H2,1-3H3 |
| InChIKey | TUOYHVCZRPUVOK-UHFFFAOYSA-N |
| XLogP | 3.23 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 302.23 |
| LogP ≤ 5 | 3.23 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of butyl-diethoxy-iodosilane?
The IUPAC name of butyl-diethoxy-iodosilane (CID 154487050) is butyl-diethoxy-iodosilane.
What is the SMILES notation for butyl-diethoxy-iodosilane?
The canonical SMILES for butyl-diethoxy-iodosilane is CCCC[Si](I)(OCC)OCC.
What is the InChIKey of butyl-diethoxy-iodosilane?
The InChIKey is TUOYHVCZRPUVOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19IO2Si/c1-4-7-8-12(9,10-5-2)11-6-3/h4-8H2,1-3H3.
What are the key properties of butyl-diethoxy-iodosilane?
butyl-diethoxy-iodosilane has a molecular weight of 302.23 g/mol, XLogP of 3.23, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-diethoxy-iodosilane is sourced from PubChem (CID 154487050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).