TL;DR: Isobutylisopropyldimethoxysilane (CAS 111439-76-0) is a chemical compound with molecular formula C9H22O2Si and molecular weight 190.1389 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethoxy-(2-methylpropyl)-propan-2-ylsilane
Also Known As: Isobutylisopropyldimethoxysilane, isobutyl(isopropyl)dimethoxysilane, dimethoxy-(2-methylpropyl)-propan-2-ylsilane, dimethoxyisobutylisopropylsilane, isopropylisobutyldimethoxysilane
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H22O2Si |
| Molecular Weight | 190.1389 g/mol |
| XLogP | 2.79 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 190.1389 Da |
| Heavy Atoms | 12 |
| Complexity | 120.0 |
| SMILES | CC(C)C[Si](C(C)C)(OC)OC |
| InChIKey | XFAOZKNGVLIXLC-UHFFFAOYSA-N |
The XLogP value of 2.79 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isobutylisopropyldimethoxysilane. With a topological polar surface area (TPSA) of 18.5 Ų, Isobutylisopropyldimethoxysilane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isobutylisopropyldimethoxysilane has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Isobutylisopropyldimethoxysilane is 111439-76-0.
The molecular formula of Isobutylisopropyldimethoxysilane is C9H22O2Si.
The molecular weight of Isobutylisopropyldimethoxysilane is 190.1389 g/mol.
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