About ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane
ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane (PubChem CID 59537888) has the molecular formula C21H48O4Si2
and a molecular weight of 420.78 g/mol. Its IUPAC name is ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane.
Molecular Properties
| Compound Name | ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane |
| PubChem CID | 59537888 |
| Molecular Formula | C21H48O4Si2 |
| Molecular Weight | 420.78 g/mol |
| Exact Mass | 420.31 |
| IUPAC Name | ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane |
| SMILES | CC[Si](C[Si](CC)(OC(C)(C)C)OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C |
| InChI | InChI=1S/C21H48O4Si2/c1-15-26(22-18(3,4)5,23-19(6,7)8)17-27(16-2,24-20(9,10)11)25-21(12,13)14/h15-17H2,1-14H3 |
| InChIKey | MAOUQKNDBMVKDT-UHFFFAOYSA-N |
| XLogP | 6.71 |
| TPSA | 36.92 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 420.78 |
| LogP ≤ 5 | 6.71 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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 ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane?
The IUPAC name of ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane (CID 59537888) is ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane.
What is the SMILES notation for ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane?
The canonical SMILES for ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane is CC[Si](C[Si](CC)(OC(C)(C)C)OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C.
What is the InChIKey of ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane?
The InChIKey is MAOUQKNDBMVKDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H48O4Si2/c1-15-26(22-18(3,4)5,23-19(6,7)8)17-27(16-2,24-20(9,10)11)25-21(12,13)14/h15-17H2,1-14H3.
What are the key properties of ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane?
ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane has a molecular weight of 420.78 g/mol, XLogP of 6.71, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-[[ethyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane is sourced from PubChem (CID 59537888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).