About dibenzylsilyloxy-tri(propan-2-yl)silane
dibenzylsilyloxy-tri(propan-2-yl)silane (PubChem CID 154004078) has the molecular formula C23H36OSi2
and a molecular weight of 384.71 g/mol. Its IUPAC name is dibenzylsilyloxy-tri(propan-2-yl)silane.
Molecular Properties
| Compound Name | dibenzylsilyloxy-tri(propan-2-yl)silane |
| PubChem CID | 154004078 |
| Molecular Formula | C23H36OSi2 |
| Molecular Weight | 384.71 g/mol |
| Exact Mass | 384.23 |
| IUPAC Name | dibenzylsilyloxy-tri(propan-2-yl)silane |
| SMILES | CC(C)[Si](O[SiH](Cc1ccccc1)Cc1ccccc1)(C(C)C)C(C)C |
| InChI | InChI=1S/C23H36OSi2/c1-19(2)26(20(3)4,21(5)6)24-25(17-22-13-9-7-10-14-22)18-23-15-11-8-12-16-23/h7-16,19-21,25H,17-18H2,1-6H3 |
| InChIKey | YWFCEXFFKUGDTB-UHFFFAOYSA-N |
| XLogP | 6.47 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 384.71 |
| LogP ≤ 5 | 6.47 |
| 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 dibenzylsilyloxy-tri(propan-2-yl)silane?
The IUPAC name of dibenzylsilyloxy-tri(propan-2-yl)silane (CID 154004078) is dibenzylsilyloxy-tri(propan-2-yl)silane.
What is the SMILES notation for dibenzylsilyloxy-tri(propan-2-yl)silane?
The canonical SMILES for dibenzylsilyloxy-tri(propan-2-yl)silane is CC(C)[Si](O[SiH](Cc1ccccc1)Cc1ccccc1)(C(C)C)C(C)C.
What is the InChIKey of dibenzylsilyloxy-tri(propan-2-yl)silane?
The InChIKey is YWFCEXFFKUGDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H36OSi2/c1-19(2)26(20(3)4,21(5)6)24-25(17-22-13-9-7-10-14-22)18-23-15-11-8-12-16-23/h7-16,19-21,25H,17-18H2,1-6H3.
What are the key properties of dibenzylsilyloxy-tri(propan-2-yl)silane?
dibenzylsilyloxy-tri(propan-2-yl)silane has a molecular weight of 384.71 g/mol, XLogP of 6.47, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzylsilyloxy-tri(propan-2-yl)silane is sourced from PubChem (CID 154004078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).