TL;DR: Sulfonium, ethyl(2-hydroxyethyl)methyl- (CAS 139097-51-1) is a chemical compound with molecular formula C5H13OS+ and molecular weight 121.06871 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl-(2-hydroxyethyl)-methylsulfanium
Also Known As: Sulfonium, ethyl(2-hydroxyethyl)methyl-, ethyl-(2-hydroxyethyl)-methylsulfanium, Sulfonium,ethyl(2-hydroxyethyl)methyl, Ethyl(2-hydroxyethyl)(methyl)sulfanium, Ethyl-(2-hydroxyethyl)-methyl-sulfanium
| Molecular Formula | C5H13OS+ |
| Molecular Weight | 121.06871 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 21.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 121.06871 Da |
| Heavy Atoms | 7 |
| Complexity | 39.0 |
| SMILES | CC[S+](C)CCO |
| InChIKey | SDOZOXGFOVACJA-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfonium, ethyl(2-hydroxyethyl)methyl-. With a topological polar surface area (TPSA) of 21.2 Ų, Sulfonium, ethyl(2-hydroxyethyl)methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sulfonium, ethyl(2-hydroxyethyl)methyl- has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Sulfonium, ethyl(2-hydroxyethyl)methyl- is 139097-51-1.
The molecular formula of Sulfonium, ethyl(2-hydroxyethyl)methyl- is C5H13OS+.
The molecular weight of Sulfonium, ethyl(2-hydroxyethyl)methyl- is 121.06871 g/mol.
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