About triethyl(7-triethylsilylheptyl)silane
triethyl(7-triethylsilylheptyl)silane (PubChem CID 174191086) has the molecular formula C19H44Si2
and a molecular weight of 328.73 g/mol. Its IUPAC name is triethyl(7-triethylsilylheptyl)silane.
Molecular Properties
| Compound Name | triethyl(7-triethylsilylheptyl)silane |
| PubChem CID | 174191086 |
| Molecular Formula | C19H44Si2 |
| Molecular Weight | 328.73 g/mol |
| Exact Mass | 328.30 |
| IUPAC Name | triethyl(7-triethylsilylheptyl)silane |
| SMILES | CC[Si](CC)(CC)CCCCCCC[Si](CC)(CC)CC |
| InChI | InChI=1S/C19H44Si2/c1-7-20(8-2,9-3)18-16-14-13-15-17-19-21(10-4,11-5)12-6/h7-19H2,1-6H3 |
| InChIKey | PBIQBMPJRXIYQQ-UHFFFAOYSA-N |
| XLogP | 7.95 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 14 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 328.73 |
| LogP ≤ 5 | 7.95 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of triethyl(7-triethylsilylheptyl)silane?
The IUPAC name of triethyl(7-triethylsilylheptyl)silane (CID 174191086) is triethyl(7-triethylsilylheptyl)silane.
What is the SMILES notation for triethyl(7-triethylsilylheptyl)silane?
The canonical SMILES for triethyl(7-triethylsilylheptyl)silane is CC[Si](CC)(CC)CCCCCCC[Si](CC)(CC)CC.
What is the InChIKey of triethyl(7-triethylsilylheptyl)silane?
The InChIKey is PBIQBMPJRXIYQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H44Si2/c1-7-20(8-2,9-3)18-16-14-13-15-17-19-21(10-4,11-5)12-6/h7-19H2,1-6H3.
What are the key properties of triethyl(7-triethylsilylheptyl)silane?
triethyl(7-triethylsilylheptyl)silane has a molecular weight of 328.73 g/mol, XLogP of 7.95, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(7-triethylsilylheptyl)silane is sourced from PubChem (CID 174191086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).