About 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane
2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane (PubChem CID 87879717) has the molecular formula C16H34OSi
and a molecular weight of 270.53 g/mol. Its IUPAC name is 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane.
Molecular Properties
| Compound Name | 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane |
| PubChem CID | 87879717 |
| Molecular Formula | C16H34OSi |
| Molecular Weight | 270.53 g/mol |
| Exact Mass | 270.24 |
| IUPAC Name | 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane |
| SMILES | C=C(C)CO[Si](CC(C)C)(C(C)C)C(C)(C)CC |
| InChI | InChI=1S/C16H34OSi/c1-10-16(8,9)18(15(6)7,12-14(4)5)17-11-13(2)3/h14-15H,2,10-12H2,1,3-9H3 |
| InChIKey | MODVWSCFTZEBGB-UHFFFAOYSA-N |
| XLogP | 5.78 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 270.53 |
| LogP ≤ 5 | 5.78 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane?
The IUPAC name of 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane (CID 87879717) is 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane.
What is the SMILES notation for 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane?
The canonical SMILES for 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane is C=C(C)CO[Si](CC(C)C)(C(C)C)C(C)(C)CC.
What is the InChIKey of 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane?
The InChIKey is MODVWSCFTZEBGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34OSi/c1-10-16(8,9)18(15(6)7,12-14(4)5)17-11-13(2)3/h14-15H,2,10-12H2,1,3-9H3.
What are the key properties of 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane?
2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane has a molecular weight of 270.53 g/mol, XLogP of 5.78, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylbutan-2-yl-(2-methylprop-2-enoxy)-(2-methylpropyl)-propan-2-ylsilane is sourced from PubChem (CID 87879717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).