About [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane
[2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane (PubChem CID 91696684) has the molecular formula C15H36O2Si2
and a molecular weight of 304.62 g/mol. Its IUPAC name is [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane.
Molecular Properties
| Compound Name | [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane |
| PubChem CID | 91696684 |
| Molecular Formula | C15H36O2Si2 |
| Molecular Weight | 304.62 g/mol |
| Exact Mass | 304.23 |
| IUPAC Name | [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane |
| SMILES | CCCCC(CC)(CO[Si](C)(C)C)CO[Si](C)(C)C |
| InChI | InChI=1S/C15H36O2Si2/c1-9-11-12-15(10-2,13-16-18(3,4)5)14-17-19(6,7)8/h9-14H2,1-8H3 |
| InChIKey | LQDMWXHNZKIHPK-UHFFFAOYSA-N |
| XLogP | 5.28 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 304.62 |
| LogP ≤ 5 | 5.28 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane?
The IUPAC name of [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane (CID 91696684) is [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane.
What is the SMILES notation for [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane?
The canonical SMILES for [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane is CCCCC(CC)(CO[Si](C)(C)C)CO[Si](C)(C)C.
What is the InChIKey of [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane?
The InChIKey is LQDMWXHNZKIHPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H36O2Si2/c1-9-11-12-15(10-2,13-16-18(3,4)5)14-17-19(6,7)8/h9-14H2,1-8H3.
What are the key properties of [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane?
[2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane has a molecular weight of 304.62 g/mol, XLogP of 5.28, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethyl-2-(trimethylsilyloxymethyl)hexoxy]-trimethylsilane is sourced from PubChem (CID 91696684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).