About trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane
trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane (PubChem CID 15366208) has the molecular formula C19H24OSi
and a molecular weight of 296.49 g/mol. Its IUPAC name is trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane.
Molecular Properties
| Compound Name | trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane |
| PubChem CID | 15366208 |
| Molecular Formula | C19H24OSi |
| Molecular Weight | 296.49 g/mol |
| Exact Mass | 296.16 |
| IUPAC Name | trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane |
| SMILES | C[Si](C)(C)OC1=CC(c2cccc3ccccc23)CCC1 |
| InChI | InChI=1S/C19H24OSi/c1-21(2,3)20-17-11-6-10-16(14-17)19-13-7-9-15-8-4-5-12-18(15)19/h4-5,7-9,12-14,16H,6,10-11H2,1-3H3 |
| InChIKey | UMMJWMVDAJGUTA-UHFFFAOYSA-N |
| XLogP | 5.84 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 296.49 |
| LogP ≤ 5 | 5.84 |
| 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 trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane?
The IUPAC name of trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane (CID 15366208) is trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane.
What is the SMILES notation for trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane?
The canonical SMILES for trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane is C[Si](C)(C)OC1=CC(c2cccc3ccccc23)CCC1.
What is the InChIKey of trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane?
The InChIKey is UMMJWMVDAJGUTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24OSi/c1-21(2,3)20-17-11-6-10-16(14-17)19-13-7-9-15-8-4-5-12-18(15)19/h4-5,7-9,12-14,16H,6,10-11H2,1-3H3.
What are the key properties of trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane?
trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane has a molecular weight of 296.49 g/mol, XLogP of 5.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(3-naphthalen-1-ylcyclohexen-1-yl)oxysilane is sourced from PubChem (CID 15366208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).