About trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane
trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane (PubChem CID 23650631) has the molecular formula C17H36O2Si
and a molecular weight of 300.56 g/mol. Its IUPAC name is trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane.
Molecular Properties
| Compound Name | trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane |
| PubChem CID | 23650631 |
| Molecular Formula | C17H36O2Si |
| Molecular Weight | 300.56 g/mol |
| Exact Mass | 300.25 |
| IUPAC Name | trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane |
| SMILES | CCCCCCCC/C=C(\OC(C)(C)C)O[Si](C)(C)C |
| InChI | InChI=1S/C17H36O2Si/c1-8-9-10-11-12-13-14-15-16(18-17(2,3)4)19-20(5,6)7/h15H,8-14H2,1-7H3/b16-15+ |
| InChIKey | FOXLFSLXZRXEHP-FOCLMDBBSA-N |
| XLogP | 6.24 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 300.56 |
| LogP ≤ 5 | 6.24 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]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 trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane?
The IUPAC name of trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane (CID 23650631) is trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane.
What is the SMILES notation for trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane?
The canonical SMILES for trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane is CCCCCCCC/C=C(\OC(C)(C)C)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane?
The InChIKey is FOXLFSLXZRXEHP-FOCLMDBBSA-N. The full InChI is InChI=1S/C17H36O2Si/c1-8-9-10-11-12-13-14-15-16(18-17(2,3)4)19-20(5,6)7/h15H,8-14H2,1-7H3/b16-15+.
What are the key properties of trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane?
trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane has a molecular weight of 300.56 g/mol, XLogP of 6.24, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]dec-1-enoxy]silane is sourced from PubChem (CID 23650631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).