About tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane
tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane (PubChem CID 87069102) has the molecular formula C14H34OSi2
and a molecular weight of 274.60 g/mol. Its IUPAC name is tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane.
Molecular Properties
| Compound Name | tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane |
| PubChem CID | 87069102 |
| Molecular Formula | C14H34OSi2 |
| Molecular Weight | 274.60 g/mol |
| Exact Mass | 274.21 |
| IUPAC Name | tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane |
| SMILES | CC[Si](C)(O[Si](C)(CC)C(C)(C)C)C(C)(C)C |
| InChI | InChI=1S/C14H34OSi2/c1-11-16(9,13(3,4)5)15-17(10,12-2)14(6,7)8/h11-12H2,1-10H3 |
| InChIKey | SEOKRSCVBBFQND-UHFFFAOYSA-N |
| XLogP | 5.79 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 274.60 |
| LogP ≤ 5 | 5.79 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane?
The IUPAC name of tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane (CID 87069102) is tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane.
What is the SMILES notation for tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane?
The canonical SMILES for tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane is CC[Si](C)(O[Si](C)(CC)C(C)(C)C)C(C)(C)C.
What is the InChIKey of tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane?
The InChIKey is SEOKRSCVBBFQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H34OSi2/c1-11-16(9,13(3,4)5)15-17(10,12-2)14(6,7)8/h11-12H2,1-10H3.
What are the key properties of tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane?
tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane has a molecular weight of 274.60 g/mol, XLogP of 5.79, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane is sourced from PubChem (CID 87069102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).