About tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane
tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane (PubChem CID 87144652) has the molecular formula C22H50O6Si2
and a molecular weight of 466.81 g/mol. Its IUPAC name is tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane.
Molecular Properties
| Compound Name | tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane |
| PubChem CID | 87144652 |
| Molecular Formula | C22H50O6Si2 |
| Molecular Weight | 466.81 g/mol |
| Exact Mass | 466.31 |
| IUPAC Name | tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane |
| SMILES | CC(C)O[Si](CCCC[Si](OC(C)C)(OC(C)C)OC(C)C)(OC(C)C)OC(C)C |
| InChI | InChI=1S/C22H50O6Si2/c1-17(2)23-29(24-18(3)4,25-19(5)6)15-13-14-16-30(26-20(7)8,27-21(9)10)28-22(11)12/h17-22H,13-16H2,1-12H3 |
| InChIKey | GCOZHNHUOYMQLV-UHFFFAOYSA-N |
| XLogP | 6.19 |
| TPSA | 55.38 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 17 |
| Heavy Atoms | 30 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 466.81 |
| LogP ≤ 5 | 6.19 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
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 tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane?
The IUPAC name of tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane (CID 87144652) is tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane.
What is the SMILES notation for tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane?
The canonical SMILES for tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane is CC(C)O[Si](CCCC[Si](OC(C)C)(OC(C)C)OC(C)C)(OC(C)C)OC(C)C.
What is the InChIKey of tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane?
The InChIKey is GCOZHNHUOYMQLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H50O6Si2/c1-17(2)23-29(24-18(3)4,25-19(5)6)15-13-14-16-30(26-20(7)8,27-21(9)10)28-22(11)12/h17-22H,13-16H2,1-12H3.
What are the key properties of tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane?
tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane has a molecular weight of 466.81 g/mol, XLogP of 6.19, 17 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane is sourced from PubChem (CID 87144652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).