About trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane
trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane (PubChem CID 12937207) has the molecular formula C11H19F3Si
and a molecular weight of 236.35 g/mol. Its IUPAC name is trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane.
Molecular Properties
| Compound Name | trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane |
| PubChem CID | 12937207 |
| Molecular Formula | C11H19F3Si |
| Molecular Weight | 236.35 g/mol |
| Exact Mass | 236.12 |
| IUPAC Name | trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane |
| SMILES | C[Si](C)(C)CC1=CCCC(C(F)(F)F)C1 |
| InChI | InChI=1S/C11H19F3Si/c1-15(2,3)8-9-5-4-6-10(7-9)11(12,13)14/h5,10H,4,6-8H2,1-3H3 |
| InChIKey | SBZXCUMLOWDBLB-UHFFFAOYSA-N |
| XLogP | 4.61 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 236.35 |
| LogP ≤ 5 | 4.61 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane?
The IUPAC name of trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane (CID 12937207) is trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane.
What is the SMILES notation for trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane?
The canonical SMILES for trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane is C[Si](C)(C)CC1=CCCC(C(F)(F)F)C1.
What is the InChIKey of trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane?
The InChIKey is SBZXCUMLOWDBLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3Si/c1-15(2,3)8-9-5-4-6-10(7-9)11(12,13)14/h5,10H,4,6-8H2,1-3H3.
What are the key properties of trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane?
trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane has a molecular weight of 236.35 g/mol, XLogP of 4.61, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[5-(trifluoromethyl)cyclohexen-1-yl]methyl]silane is sourced from PubChem (CID 12937207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).