About bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane
bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane (PubChem CID 177455592) has the molecular formula C26H24O2Si
and a molecular weight of 396.56 g/mol. Its IUPAC name is bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane.
Molecular Properties
| Compound Name | bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane |
| PubChem CID | 177455592 |
| Molecular Formula | C26H24O2Si |
| Molecular Weight | 396.56 g/mol |
| Exact Mass | 396.15 |
| IUPAC Name | bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane |
| SMILES | C[Si](C)(c1ccc(/C=C/c2ccco2)cc1)c1ccc(/C=C/c2ccco2)cc1 |
| InChI | InChI=1S/C26H24O2Si/c1-29(2,25-15-9-21(10-16-25)7-13-23-5-3-19-27-23)26-17-11-22(12-18-26)8-14-24-6-4-20-28-24/h3-20H,1-2H3/b13-7+,14-8+ |
| InChIKey | WEVMZZGIXBHLAO-FNCQTZNRSA-N |
| XLogP | 6.04 |
| TPSA | 26.28 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 29 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 396.56 |
| LogP ≤ 5 | 6.04 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane?
The IUPAC name of bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane (CID 177455592) is bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane.
What is the SMILES notation for bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane?
The canonical SMILES for bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane is C[Si](C)(c1ccc(/C=C/c2ccco2)cc1)c1ccc(/C=C/c2ccco2)cc1.
What is the InChIKey of bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane?
The InChIKey is WEVMZZGIXBHLAO-FNCQTZNRSA-N. The full InChI is InChI=1S/C26H24O2Si/c1-29(2,25-15-9-21(10-16-25)7-13-23-5-3-19-27-23)26-17-11-22(12-18-26)8-14-24-6-4-20-28-24/h3-20H,1-2H3/b13-7+,14-8+.
What are the key properties of bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane?
bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane has a molecular weight of 396.56 g/mol, XLogP of 6.04, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis[4-[(E)-2-(furan-2-yl)ethenyl]phenyl]-dimethylsilane is sourced from PubChem (CID 177455592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).