TL;DR: 2,4-Dichlorophenylsulfonylethanol (CAS 107737-90-6) is a chemical compound with molecular formula C8H8Cl2O3S and molecular weight 253.95712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,4-dichlorophenyl)sulfonylethanol
Also Known As: 2,4-Dichlorophenylsulfonylethanol, 2-(2,4-dichlorophenyl)sulfonylethanol, 2-(2,4-dichlorobenzenesulfonyl)ethan-1-ol, 2-(2-chloro-benzenesulfonyl)-ethanol, 2-[(2,4-Dichlorophenyl)sulfonyl]ethanol
| Molecular Formula | C8H8Cl2O3S |
| Molecular Weight | 253.95712 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.95712 Da |
| Heavy Atoms | 14 |
| Complexity | 273.0 |
| SMILES | C1=CC(=C(C=C1Cl)Cl)S(=O)(=O)CCO |
| InChIKey | MGPKEBIUTMPMDY-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dichlorophenylsulfonylethanol. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dichlorophenylsulfonylethanol. Following Lipinski's Rule of Five, 2,4-Dichlorophenylsulfonylethanol 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-Dichlorophenylsulfonylethanol is 107737-90-6.
The molecular formula of 2,4-Dichlorophenylsulfonylethanol is C8H8Cl2O3S.
The molecular weight of 2,4-Dichlorophenylsulfonylethanol is 253.95712 g/mol.
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