TL;DR: 2-Buten-1-ol, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-2-methyl-, (1alpha(E),2beta)- (CAS 101859-31-8) is a chemical compound with molecular formula C17H34O2Si and molecular weight 298.23282 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-4-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]-2-methylbut-2-en-1-ol
Also Known As: 2-Buten-1-ol, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-2-methyl-, (1alpha(E),2beta)-, (E)-4-[(1R,2S)-2-(dimethyl-tert-butyl-silyl)oxycyclohexyl]-2-methyl-but-2-en-1-ol, (E)-4-[(1R,2S)-2-[tert-butyl(dimethyl)silyl]oxycyclohexyl]-2-methylbut-2-en-1-ol
| Molecular Formula | C17H34O2Si |
| Molecular Weight | 298.23282 g/mol |
| XLogP | 4.8957 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.23282 Da |
| Heavy Atoms | 20 |
| Complexity | 328.0 |
| SMILES | C/C(=C\C[C@H]1CCCC[C@@H]1O[Si](C)(C)C(C)(C)C)/CO |
| InChIKey | BTSOLZOZTRRJRI-MEDRYPNSSA-N |
The XLogP value of 4.8957 indicates that 2-Buten-1-ol, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-2-methyl-, (1alpha(E),2beta)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2-Buten-1-ol, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-2-methyl-, (1alpha(E),2beta)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Buten-1-ol, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-2-methyl-, (1alpha(E),2beta)- has 1 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 2-Buten-1-ol, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-2-methyl-, (1alpha(E),2beta)- is 101859-31-8.
The molecular formula of 2-Buten-1-ol, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-2-methyl-, (1alpha(E),2beta)- is C17H34O2Si.
The molecular weight of 2-Buten-1-ol, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-2-methyl-, (1alpha(E),2beta)- is 298.23282 g/mol.
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