About tert-butyl-bis[di(propan-2-yl)silyloxy]silane
tert-butyl-bis[di(propan-2-yl)silyloxy]silane (PubChem CID 151519390) has the molecular formula C16H40O2Si3
and a molecular weight of 348.75 g/mol. Its IUPAC name is tert-butyl-bis[di(propan-2-yl)silyloxy]silane.
Molecular Properties
| Compound Name | tert-butyl-bis[di(propan-2-yl)silyloxy]silane |
| PubChem CID | 151519390 |
| Molecular Formula | C16H40O2Si3 |
| Molecular Weight | 348.75 g/mol |
| Exact Mass | 348.23 |
| IUPAC Name | tert-butyl-bis[di(propan-2-yl)silyloxy]silane |
| SMILES | CC(C)[SiH](O[SiH](O[SiH](C(C)C)C(C)C)C(C)(C)C)C(C)C |
| InChI | InChI=1S/C16H40O2Si3/c1-12(2)19(13(3)4)17-21(16(9,10)11)18-20(14(5)6)15(7)8/h12-15,19-21H,1-11H3 |
| InChIKey | PUDQQLTYOFYSQO-UHFFFAOYSA-N |
| XLogP | 5.13 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 348.75 |
| LogP ≤ 5 | 5.13 |
| 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 tert-butyl-bis[di(propan-2-yl)silyloxy]silane?
The IUPAC name of tert-butyl-bis[di(propan-2-yl)silyloxy]silane (CID 151519390) is tert-butyl-bis[di(propan-2-yl)silyloxy]silane.
What is the SMILES notation for tert-butyl-bis[di(propan-2-yl)silyloxy]silane?
The canonical SMILES for tert-butyl-bis[di(propan-2-yl)silyloxy]silane is CC(C)[SiH](O[SiH](O[SiH](C(C)C)C(C)C)C(C)(C)C)C(C)C.
What is the InChIKey of tert-butyl-bis[di(propan-2-yl)silyloxy]silane?
The InChIKey is PUDQQLTYOFYSQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H40O2Si3/c1-12(2)19(13(3)4)17-21(16(9,10)11)18-20(14(5)6)15(7)8/h12-15,19-21H,1-11H3.
What are the key properties of tert-butyl-bis[di(propan-2-yl)silyloxy]silane?
tert-butyl-bis[di(propan-2-yl)silyloxy]silane has a molecular weight of 348.75 g/mol, XLogP of 5.13, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-bis[di(propan-2-yl)silyloxy]silane is sourced from PubChem (CID 151519390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).