TL;DR: 2-(4-Methanesulfinyl-phenyl)-ethanol (CAS 1007494-00-9) is a chemical compound with molecular formula C9H12O2S and molecular weight 184.0558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-methylsulfinylphenyl)ethanol
Also Known As: 2-(4-methylsulfinylphenyl)ethanol, 2-(4-methanesulfinyl-phenyl)-ethanol, 4-(Methylsulfinyl)benzeneethanol, 2-(4-methanesulfinylphenyl)ethan-1-ol
| Molecular Formula | C9H12O2S |
| Molecular Weight | 184.0558 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 56.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.0558 Da |
| Heavy Atoms | 12 |
| Complexity | 151.0 |
| SMILES | CS(=O)C1=CC=C(C=C1)CCO |
| InChIKey | LXMXFBFAHOYNFG-UHFFFAOYSA-N |
The XLogP value of -0.1 indicates that 2-(4-Methanesulfinyl-phenyl)-ethanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.5 Ų, 2-(4-Methanesulfinyl-phenyl)-ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methanesulfinyl-phenyl)-ethanol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(4-Methanesulfinyl-phenyl)-ethanol is 1007494-00-9.
The molecular formula of 2-(4-Methanesulfinyl-phenyl)-ethanol is C9H12O2S.
The molecular weight of 2-(4-Methanesulfinyl-phenyl)-ethanol is 184.0558 g/mol.
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