About triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane
triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane (PubChem CID 153422025) has the molecular formula C22H52O3Si3
and a molecular weight of 448.91 g/mol. Its IUPAC name is triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane.
Molecular Properties
| Compound Name | triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane |
| PubChem CID | 153422025 |
| Molecular Formula | C22H52O3Si3 |
| Molecular Weight | 448.91 g/mol |
| Exact Mass | 448.32 |
| IUPAC Name | triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane |
| SMILES | CC[Si](CC)(CC)OCCC(CCO[Si](C)(C)C)CCO[Si](CC)(CC)CC |
| InChI | InChI=1S/C22H52O3Si3/c1-10-27(11-2,12-3)24-20-17-22(16-19-23-26(7,8)9)18-21-25-28(13-4,14-5)15-6/h22H,10-21H2,1-9H3 |
| InChIKey | UULIHKRWHFBKQN-UHFFFAOYSA-N |
| XLogP | 7.67 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 28 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 448.91 |
| LogP ≤ 5 | 7.67 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]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 triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane?
The IUPAC name of triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane (CID 153422025) is triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane.
What is the SMILES notation for triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane?
The canonical SMILES for triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane is CC[Si](CC)(CC)OCCC(CCO[Si](C)(C)C)CCO[Si](CC)(CC)CC.
What is the InChIKey of triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane?
The InChIKey is UULIHKRWHFBKQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H52O3Si3/c1-10-27(11-2,12-3)24-20-17-22(16-19-23-26(7,8)9)18-21-25-28(13-4,14-5)15-6/h22H,10-21H2,1-9H3.
What are the key properties of triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane?
triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane has a molecular weight of 448.91 g/mol, XLogP of 7.67, 18 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[3-(2-triethylsilyloxyethyl)-5-trimethylsilyloxypentoxy]silane is sourced from PubChem (CID 153422025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).