About dimethyl-bis(2-triethoxysilylethoxy)silane
dimethyl-bis(2-triethoxysilylethoxy)silane (PubChem CID 121233875) has the molecular formula C18H44O8Si3
and a molecular weight of 472.80 g/mol. Its IUPAC name is dimethyl-bis(2-triethoxysilylethoxy)silane.
Molecular Properties
| Compound Name | dimethyl-bis(2-triethoxysilylethoxy)silane |
| PubChem CID | 121233875 |
| Molecular Formula | C18H44O8Si3 |
| Molecular Weight | 472.80 g/mol |
| Exact Mass | 472.23 |
| IUPAC Name | dimethyl-bis(2-triethoxysilylethoxy)silane |
| SMILES | CCO[Si](CCO[Si](C)(C)OCC[Si](OCC)(OCC)OCC)(OCC)OCC |
| InChI | InChI=1S/C18H44O8Si3/c1-9-19-28(20-10-2,21-11-3)17-15-25-27(7,8)26-16-18-29(22-12-4,23-13-5)24-14-6/h9-18H2,1-8H3 |
| InChIKey | UGUPIRDXTCBLEQ-UHFFFAOYSA-N |
| XLogP | 3.82 |
| TPSA | 73.84 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 29 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 472.80 |
| LogP ≤ 5 | 3.82 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |
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 dimethyl-bis(2-triethoxysilylethoxy)silane?
The IUPAC name of dimethyl-bis(2-triethoxysilylethoxy)silane (CID 121233875) is dimethyl-bis(2-triethoxysilylethoxy)silane.
What is the SMILES notation for dimethyl-bis(2-triethoxysilylethoxy)silane?
The canonical SMILES for dimethyl-bis(2-triethoxysilylethoxy)silane is CCO[Si](CCO[Si](C)(C)OCC[Si](OCC)(OCC)OCC)(OCC)OCC.
What is the InChIKey of dimethyl-bis(2-triethoxysilylethoxy)silane?
The InChIKey is UGUPIRDXTCBLEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H44O8Si3/c1-9-19-28(20-10-2,21-11-3)17-15-25-27(7,8)26-16-18-29(22-12-4,23-13-5)24-14-6/h9-18H2,1-8H3.
What are the key properties of dimethyl-bis(2-triethoxysilylethoxy)silane?
dimethyl-bis(2-triethoxysilylethoxy)silane has a molecular weight of 472.80 g/mol, XLogP of 3.82, 20 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(2-triethoxysilylethoxy)silane is sourced from PubChem (CID 121233875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).