About ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane
ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane (PubChem CID 91733071) has the molecular formula C13H28O2Si
and a molecular weight of 244.45 g/mol. Its IUPAC name is ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane.
Molecular Properties
| Compound Name | ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane |
| PubChem CID | 91733071 |
| Molecular Formula | C13H28O2Si |
| Molecular Weight | 244.45 g/mol |
| Exact Mass | 244.19 |
| IUPAC Name | ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane |
| SMILES | C=C[Si](C)(OCC(C)C)OC(CC)C(C)C |
| InChI | InChI=1S/C13H28O2Si/c1-8-13(12(5)6)15-16(7,9-2)14-10-11(3)4/h9,11-13H,2,8,10H2,1,3-7H3 |
| InChIKey | OUXBISSDPQVSAU-UHFFFAOYSA-N |
| XLogP | 3.91 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 244.45 |
| LogP ≤ 5 | 3.91 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane?
The IUPAC name of ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane (CID 91733071) is ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane.
What is the SMILES notation for ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane?
The canonical SMILES for ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane is C=C[Si](C)(OCC(C)C)OC(CC)C(C)C.
What is the InChIKey of ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane?
The InChIKey is OUXBISSDPQVSAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-8-13(12(5)6)15-16(7,9-2)14-10-11(3)4/h9,11-13H,2,8,10H2,1,3-7H3.
What are the key properties of ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane?
ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane has a molecular weight of 244.45 g/mol, XLogP of 3.91, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-methyl-(2-methylpentan-3-yloxy)-(2-methylpropoxy)silane is sourced from PubChem (CID 91733071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).