About 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane
2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane (PubChem CID 134885868) has the molecular formula C11H18OSi
and a molecular weight of 194.35 g/mol. Its IUPAC name is 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane.
Molecular Properties
| Compound Name | 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane |
| PubChem CID | 134885868 |
| Molecular Formula | C11H18OSi |
| Molecular Weight | 194.35 g/mol |
| Exact Mass | 194.11 |
| IUPAC Name | 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane |
| SMILES | C=CC1OC1(C#C[Si](C)(C)C)CC |
| InChI | InChI=1S/C11H18OSi/c1-6-10-11(7-2,12-10)8-9-13(3,4)5/h6,10H,1,7H2,2-5H3 |
| InChIKey | QLYIRURGVDXWAV-UHFFFAOYSA-N |
| XLogP | 2.60 |
| TPSA | 12.53 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 194.35 |
| LogP ≤ 5 | 2.60 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane?
The IUPAC name of 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane (CID 134885868) is 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane.
What is the SMILES notation for 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane?
The canonical SMILES for 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane is C=CC1OC1(C#C[Si](C)(C)C)CC.
What is the InChIKey of 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane?
The InChIKey is QLYIRURGVDXWAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18OSi/c1-6-10-11(7-2,12-10)8-9-13(3,4)5/h6,10H,1,7H2,2-5H3.
What are the key properties of 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane?
2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane has a molecular weight of 194.35 g/mol, XLogP of 2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethenyl-2-ethyloxiran-2-yl)ethynyl-trimethylsilane is sourced from PubChem (CID 134885868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).