About methyl-oct-1-enyl-dioctylsilane
methyl-oct-1-enyl-dioctylsilane (PubChem CID 173411887) has the molecular formula C25H52Si
and a molecular weight of 380.78 g/mol. Its IUPAC name is methyl-oct-1-enyl-dioctylsilane.
Molecular Properties
| Compound Name | methyl-oct-1-enyl-dioctylsilane |
| PubChem CID | 173411887 |
| Molecular Formula | C25H52Si |
| Molecular Weight | 380.78 g/mol |
| Exact Mass | 380.38 |
| IUPAC Name | methyl-oct-1-enyl-dioctylsilane |
| SMILES | CCCCCCC=C[Si](C)(CCCCCCCC)CCCCCCCC |
| InChI | InChI=1S/C25H52Si/c1-5-8-11-14-17-20-23-26(4,24-21-18-15-12-9-6-2)25-22-19-16-13-10-7-3/h20,23H,5-19,21-22,24-25H2,1-4H3 |
| InChIKey | AIQWSXJEOSCIJZ-UHFFFAOYSA-N |
| XLogP | 9.85 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 20 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 380.78 |
| LogP ≤ 5 | 9.85 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of methyl-oct-1-enyl-dioctylsilane?
The IUPAC name of methyl-oct-1-enyl-dioctylsilane (CID 173411887) is methyl-oct-1-enyl-dioctylsilane.
What is the SMILES notation for methyl-oct-1-enyl-dioctylsilane?
The canonical SMILES for methyl-oct-1-enyl-dioctylsilane is CCCCCCC=C[Si](C)(CCCCCCCC)CCCCCCCC.
What is the InChIKey of methyl-oct-1-enyl-dioctylsilane?
The InChIKey is AIQWSXJEOSCIJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H52Si/c1-5-8-11-14-17-20-23-26(4,24-21-18-15-12-9-6-2)25-22-19-16-13-10-7-3/h20,23H,5-19,21-22,24-25H2,1-4H3.
What are the key properties of methyl-oct-1-enyl-dioctylsilane?
methyl-oct-1-enyl-dioctylsilane has a molecular weight of 380.78 g/mol, XLogP of 9.85, 20 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-oct-1-enyl-dioctylsilane is sourced from PubChem (CID 173411887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).