About tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane
tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane (PubChem CID 87934278) has the molecular formula C20H42O9Si
and a molecular weight of 454.63 g/mol. Its IUPAC name is tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane.
Molecular Properties
| Compound Name | tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane |
| PubChem CID | 87934278 |
| Molecular Formula | C20H42O9Si |
| Molecular Weight | 454.63 g/mol |
| Exact Mass | 454.26 |
| IUPAC Name | tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane |
| SMILES | C=CCCC[Si](OCCOCCOC)(OCCOCCOC)OCCOCCOC |
| InChI | InChI=1S/C20H42O9Si/c1-5-6-7-20-30(27-17-14-24-11-8-21-2,28-18-15-25-12-9-22-3)29-19-16-26-13-10-23-4/h5H,1,6-20H2,2-4H3 |
| InChIKey | KANIWCCXDCWYIZ-UHFFFAOYSA-N |
| XLogP | 1.93 |
| TPSA | 83.07 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 9 |
| Rotatable Bonds | 25 |
| Heavy Atoms | 30 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 454.63 |
| LogP ≤ 5 | 1.93 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 9 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
|---|
Analyze tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane 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 tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane?
The IUPAC name of tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane (CID 87934278) is tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane.
What is the SMILES notation for tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane?
The canonical SMILES for tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane is C=CCCC[Si](OCCOCCOC)(OCCOCCOC)OCCOCCOC.
What is the InChIKey of tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane?
The InChIKey is KANIWCCXDCWYIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42O9Si/c1-5-6-7-20-30(27-17-14-24-11-8-21-2,28-18-15-25-12-9-22-3)29-19-16-26-13-10-23-4/h5H,1,6-20H2,2-4H3.
What are the key properties of tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane?
tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane has a molecular weight of 454.63 g/mol, XLogP of 1.93, 25 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for tris[2-(2-methoxyethoxy)ethoxy]-pent-4-enylsilane is sourced from PubChem (CID 87934278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).