About triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane
triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane (PubChem CID 10712748) has the molecular formula C21H40Si2
and a molecular weight of 348.72 g/mol. Its IUPAC name is triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane.
Molecular Properties
| Compound Name | triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane |
| PubChem CID | 10712748 |
| Molecular Formula | C21H40Si2 |
| Molecular Weight | 348.72 g/mol |
| Exact Mass | 348.27 |
| IUPAC Name | triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane |
| SMILES | CC[Si](/C=C/C1=C(/C=C/[Si](CC)(CC)CC)CCC1)(CC)CC |
| InChI | InChI=1S/C21H40Si2/c1-7-22(8-2,9-3)18-16-20-14-13-15-21(20)17-19-23(10-4,11-5)12-6/h16-19H,7-15H2,1-6H3/b18-16+,19-17+ |
| InChIKey | NKWQESOZPNBGQK-YWNVXTCZSA-N |
| XLogP | 7.67 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 10 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 348.72 |
| LogP ≤ 5 | 7.67 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane?
The IUPAC name of triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane (CID 10712748) is triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane.
What is the SMILES notation for triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane?
The canonical SMILES for triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane is CC[Si](/C=C/C1=C(/C=C/[Si](CC)(CC)CC)CCC1)(CC)CC.
What is the InChIKey of triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane?
The InChIKey is NKWQESOZPNBGQK-YWNVXTCZSA-N. The full InChI is InChI=1S/C21H40Si2/c1-7-22(8-2,9-3)18-16-20-14-13-15-21(20)17-19-23(10-4,11-5)12-6/h16-19H,7-15H2,1-6H3/b18-16+,19-17+.
What are the key properties of triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane?
triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane has a molecular weight of 348.72 g/mol, XLogP of 7.67, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(E)-2-[2-[(E)-2-triethylsilylethenyl]cyclopenten-1-yl]ethenyl]silane is sourced from PubChem (CID 10712748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).