TL;DR: Hexanoic acid, trimethylsilyl ester (CAS 14246-15-2) is a chemical compound with molecular formula C9H20O2Si and molecular weight 188.12326 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethylsilyl hexanoate
Also Known As: Trimethylsilyl hexanoate, Hexanoic acid, trimethylsilyl ester, trimethylsilyl caproate, Trimethylsilyl hexanoate #, Hexanoic acid trimethylsilyl ester
| Molecular Formula | C9H20O2Si |
| Molecular Weight | 188.12326 g/mol |
| XLogP | 2.9448 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 188.12326 Da |
| Heavy Atoms | 12 |
| Complexity | 138.0 |
| SMILES | CCCCCC(=O)O[Si](C)(C)C |
| InChIKey | CYXNJMDACJPPRR-UHFFFAOYSA-N |
The XLogP value of 2.9448 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanoic acid, trimethylsilyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Hexanoic acid, trimethylsilyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexanoic acid, trimethylsilyl ester 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 Hexanoic acid, trimethylsilyl ester is 14246-15-2.
The molecular formula of Hexanoic acid, trimethylsilyl ester is C9H20O2Si.
The molecular weight of Hexanoic acid, trimethylsilyl ester is 188.12326 g/mol.
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