About 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane
3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane (PubChem CID 101005250) has the molecular formula C13H20Si
and a molecular weight of 204.39 g/mol. Its IUPAC name is 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane.
Molecular Properties
| Compound Name | 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane |
| PubChem CID | 101005250 |
| Molecular Formula | C13H20Si |
| Molecular Weight | 204.39 g/mol |
| Exact Mass | 204.13 |
| IUPAC Name | 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane |
| SMILES | C=C[Si](C)(C)C#CC=C1CCCCC1 |
| InChI | InChI=1S/C13H20Si/c1-4-14(2,3)12-8-11-13-9-6-5-7-10-13/h4,11H,1,5-7,9-10H2,2-3H3 |
| InChIKey | XZZPDNPWPXMZLJ-UHFFFAOYSA-N |
| XLogP | 3.85 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 204.39 |
| LogP ≤ 5 | 3.85 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane?
The IUPAC name of 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane (CID 101005250) is 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane.
What is the SMILES notation for 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane?
The canonical SMILES for 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane is C=C[Si](C)(C)C#CC=C1CCCCC1.
What is the InChIKey of 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane?
The InChIKey is XZZPDNPWPXMZLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20Si/c1-4-14(2,3)12-8-11-13-9-6-5-7-10-13/h4,11H,1,5-7,9-10H2,2-3H3.
What are the key properties of 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane?
3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane has a molecular weight of 204.39 g/mol, XLogP of 3.85, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexylideneprop-1-ynyl-ethenyl-dimethylsilane is sourced from PubChem (CID 101005250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).