About (2-hexylcyclopenten-1-yl)-trimethylsilane
(2-hexylcyclopenten-1-yl)-trimethylsilane (PubChem CID 553181) has the molecular formula C14H28Si
and a molecular weight of 224.46 g/mol. Its IUPAC name is (2-hexylcyclopenten-1-yl)-trimethylsilane.
Molecular Properties
| Compound Name | (2-hexylcyclopenten-1-yl)-trimethylsilane |
| PubChem CID | 553181 |
| Molecular Formula | C14H28Si |
| Molecular Weight | 224.46 g/mol |
| Exact Mass | 224.20 |
| IUPAC Name | (2-hexylcyclopenten-1-yl)-trimethylsilane |
| SMILES | CCCCCCC1=C([Si](C)(C)C)CCC1 |
| InChI | InChI=1S/C14H28Si/c1-5-6-7-8-10-13-11-9-12-14(13)15(2,3)4/h5-12H2,1-4H3 |
| InChIKey | BAWNMZZVCTZHDU-UHFFFAOYSA-N |
| XLogP | 5.31 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 6 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 224.46 |
| LogP ≤ 5 | 5.31 |
| 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 (2-hexylcyclopenten-1-yl)-trimethylsilane?
The IUPAC name of (2-hexylcyclopenten-1-yl)-trimethylsilane (CID 553181) is (2-hexylcyclopenten-1-yl)-trimethylsilane.
What is the SMILES notation for (2-hexylcyclopenten-1-yl)-trimethylsilane?
The canonical SMILES for (2-hexylcyclopenten-1-yl)-trimethylsilane is CCCCCCC1=C([Si](C)(C)C)CCC1.
What is the InChIKey of (2-hexylcyclopenten-1-yl)-trimethylsilane?
The InChIKey is BAWNMZZVCTZHDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28Si/c1-5-6-7-8-10-13-11-9-12-14(13)15(2,3)4/h5-12H2,1-4H3.
What are the key properties of (2-hexylcyclopenten-1-yl)-trimethylsilane?
(2-hexylcyclopenten-1-yl)-trimethylsilane has a molecular weight of 224.46 g/mol, XLogP of 5.31, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hexylcyclopenten-1-yl)-trimethylsilane is sourced from PubChem (CID 553181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).