About triethoxy(3-methylbut-2-enyl)silane
triethoxy(3-methylbut-2-enyl)silane (PubChem CID 12504384) has the molecular formula C11H24O3Si
and a molecular weight of 232.40 g/mol. Its IUPAC name is triethoxy(3-methylbut-2-enyl)silane.
Molecular Properties
| Compound Name | triethoxy(3-methylbut-2-enyl)silane |
| PubChem CID | 12504384 |
| Molecular Formula | C11H24O3Si |
| Molecular Weight | 232.40 g/mol |
| Exact Mass | 232.15 |
| IUPAC Name | triethoxy(3-methylbut-2-enyl)silane |
| SMILES | CCO[Si](CC=C(C)C)(OCC)OCC |
| InChI | InChI=1S/C11H24O3Si/c1-6-12-15(13-7-2,14-8-3)10-9-11(4)5/h9H,6-8,10H2,1-5H3 |
| InChIKey | WSSLXSMPZCPGTR-UHFFFAOYSA-N |
| XLogP | 3.00 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 232.40 |
| LogP ≤ 5 | 3.00 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of triethoxy(3-methylbut-2-enyl)silane?
The IUPAC name of triethoxy(3-methylbut-2-enyl)silane (CID 12504384) is triethoxy(3-methylbut-2-enyl)silane.
What is the SMILES notation for triethoxy(3-methylbut-2-enyl)silane?
The canonical SMILES for triethoxy(3-methylbut-2-enyl)silane is CCO[Si](CC=C(C)C)(OCC)OCC.
What is the InChIKey of triethoxy(3-methylbut-2-enyl)silane?
The InChIKey is WSSLXSMPZCPGTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3Si/c1-6-12-15(13-7-2,14-8-3)10-9-11(4)5/h9H,6-8,10H2,1-5H3.
What are the key properties of triethoxy(3-methylbut-2-enyl)silane?
triethoxy(3-methylbut-2-enyl)silane has a molecular weight of 232.40 g/mol, XLogP of 3.00, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(3-methylbut-2-enyl)silane is sourced from PubChem (CID 12504384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).