About triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane
triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane (PubChem CID 71321392) has the molecular formula C17H38Si2
and a molecular weight of 298.66 g/mol. Its IUPAC name is triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane.
Molecular Properties
| Compound Name | triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane |
| PubChem CID | 71321392 |
| Molecular Formula | C17H38Si2 |
| Molecular Weight | 298.66 g/mol |
| Exact Mass | 298.25 |
| IUPAC Name | triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane |
| SMILES | CC[Si](CC)(CC)CC=C(C)C[Si](CC)(CC)CC |
| InChI | InChI=1S/C17H38Si2/c1-8-18(9-2,10-3)15-14-17(7)16-19(11-4,12-5)13-6/h14H,8-13,15-16H2,1-7H3 |
| InChIKey | YTZDSKKCPDNBKE-UHFFFAOYSA-N |
| XLogP | 6.95 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 10 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 298.66 |
| LogP ≤ 5 | 6.95 |
| 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 triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane?
The IUPAC name of triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane (CID 71321392) is triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane.
What is the SMILES notation for triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane?
The canonical SMILES for triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane is CC[Si](CC)(CC)CC=C(C)C[Si](CC)(CC)CC.
What is the InChIKey of triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane?
The InChIKey is YTZDSKKCPDNBKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38Si2/c1-8-18(9-2,10-3)15-14-17(7)16-19(11-4,12-5)13-6/h14H,8-13,15-16H2,1-7H3.
What are the key properties of triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane?
triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane has a molecular weight of 298.66 g/mol, XLogP of 6.95, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(2-methyl-4-triethylsilylbut-2-enyl)silane is sourced from PubChem (CID 71321392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).