TL;DR: 2-Amino-4-(ethylsulphonyl)phenol hydrochloride (CAS 13921-03-4) is a chemical compound with molecular formula C8H12ClNO3S and molecular weight 237.02264 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-4-ethylsulfonylphenol;hydrochloride
Also Known As: 2-Amino-4-(ethylsulphonyl)phenol hydrochloride, 2-Amino-4-(ethylsulphonyl)phenol HCl, EINECS 237-689-4, 2-Amino-4-(ethylsulfonyl)phenol hydrochloride, 2-amino-4-ethylsulfonylphenol hydrochloride
| Molecular Formula | C8H12ClNO3S |
| Molecular Weight | 237.02264 g/mol |
| XLogP | 1.1898 |
| Topological Polar Surface Area (TPSA) | 88.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.02264 Da |
| Heavy Atoms | 14 |
| Complexity | 257.0 |
| SMILES | CCS(=O)(=O)C1=CC(=C(C=C1)O)N.Cl |
| InChIKey | LHVYMKQYEXNDLW-UHFFFAOYSA-N |
The XLogP value of 1.1898 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-4-(ethylsulphonyl)phenol hydrochloride. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4-(ethylsulphonyl)phenol hydrochloride. Following Lipinski's Rule of Five, 2-Amino-4-(ethylsulphonyl)phenol hydrochloride has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Amino-4-(ethylsulphonyl)phenol hydrochloride is 13921-03-4.
The molecular formula of 2-Amino-4-(ethylsulphonyl)phenol hydrochloride is C8H12ClNO3S.
The molecular weight of 2-Amino-4-(ethylsulphonyl)phenol hydrochloride is 237.02264 g/mol.
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