About triethoxy(undec-1-enyl)silane
triethoxy(undec-1-enyl)silane (PubChem CID 140758879) has the molecular formula C17H36O3Si
and a molecular weight of 316.56 g/mol. Its IUPAC name is triethoxy(undec-1-enyl)silane.
Molecular Properties
| Compound Name | triethoxy(undec-1-enyl)silane |
| PubChem CID | 140758879 |
| Molecular Formula | C17H36O3Si |
| Molecular Weight | 316.56 g/mol |
| Exact Mass | 316.24 |
| IUPAC Name | triethoxy(undec-1-enyl)silane |
| SMILES | CCCCCCCCCC=C[Si](OCC)(OCC)OCC |
| InChI | InChI=1S/C17H36O3Si/c1-5-9-10-11-12-13-14-15-16-17-21(18-6-2,19-7-3)20-8-4/h16-17H,5-15H2,1-4H3 |
| InChIKey | BBVPCLYTYWUYHM-UHFFFAOYSA-N |
| XLogP | 5.27 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 316.56 |
| LogP ≤ 5 | 5.27 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze triethoxy(undec-1-enyl)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 triethoxy(undec-1-enyl)silane?
The IUPAC name of triethoxy(undec-1-enyl)silane (CID 140758879) is triethoxy(undec-1-enyl)silane.
What is the SMILES notation for triethoxy(undec-1-enyl)silane?
The canonical SMILES for triethoxy(undec-1-enyl)silane is CCCCCCCCCC=C[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy(undec-1-enyl)silane?
The InChIKey is BBVPCLYTYWUYHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36O3Si/c1-5-9-10-11-12-13-14-15-16-17-21(18-6-2,19-7-3)20-8-4/h16-17H,5-15H2,1-4H3.
What are the key properties of triethoxy(undec-1-enyl)silane?
triethoxy(undec-1-enyl)silane has a molecular weight of 316.56 g/mol, XLogP of 5.27, 15 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(undec-1-enyl)silane is sourced from PubChem (CID 140758879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).