About 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone
1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone (PubChem CID 11652058) has the molecular formula C18H20OSi
and a molecular weight of 280.44 g/mol. Its IUPAC name is 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone.
Molecular Properties
| Compound Name | 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone |
| PubChem CID | 11652058 |
| Molecular Formula | C18H20OSi |
| Molecular Weight | 280.44 g/mol |
| Exact Mass | 280.13 |
| IUPAC Name | 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone |
| SMILES | CC(=O)c1ccc(/C=C\[Si](C)(C)c2ccccc2)cc1 |
| InChI | InChI=1S/C18H20OSi/c1-15(19)17-11-9-16(10-12-17)13-14-20(2,3)18-7-5-4-6-8-18/h4-14H,1-3H3/b14-13- |
| InChIKey | AVDBZPWJAFCGLJ-YPKPFQOOSA-N |
| XLogP | 4.06 |
| TPSA | 17.07 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 280.44 |
| LogP ≤ 5 | 4.06 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone?
The IUPAC name of 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone (CID 11652058) is 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone.
What is the SMILES notation for 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone?
The canonical SMILES for 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone is CC(=O)c1ccc(/C=C\[Si](C)(C)c2ccccc2)cc1.
What is the InChIKey of 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone?
The InChIKey is AVDBZPWJAFCGLJ-YPKPFQOOSA-N. The full InChI is InChI=1S/C18H20OSi/c1-15(19)17-11-9-16(10-12-17)13-14-20(2,3)18-7-5-4-6-8-18/h4-14H,1-3H3/b14-13-.
What are the key properties of 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone?
1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone has a molecular weight of 280.44 g/mol, XLogP of 4.06, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(Z)-2-[dimethyl(phenyl)silyl]ethenyl]phenyl]ethanone is sourced from PubChem (CID 11652058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).