TL;DR: Thiosulfuric acid, S-(2-(ethylamino)-1-(3-hydroxyphenyl)ethyl) ester (CAS 119610-63-8) is a chemical compound with molecular formula C10H15NO4S2 and molecular weight 277.04425 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(ethylamino)-1-sulfosulfanylethyl]-3-hydroxybenzene
Also Known As: 1-(3-Hydroxyphenyl)-2-ethylaminoethylthiosulfuric acid, Thiosulfuric acid, S-(2-(ethylamino)-1-(3-hydroxyphenyl)ethyl) ester, 1-[2-(ethylamino)-1-sulfosulfanylethyl]-3-hydroxybenzene, S-[2-(Ethylamino)-1-(3-hydroxyphenyl)ethyl] hydrogen sulfurothioate, S-2-(Ethylamino)-1-(3-hydroxyphenyl)ethyl hydrogen sulfurothioate
| Molecular Formula | C10H15NO4S2 |
| Molecular Weight | 277.04425 g/mol |
| XLogP | -1.6 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 277.04425 Da |
| Heavy Atoms | 17 |
| Complexity | 315.0 |
| SMILES | CCNCC(C1=CC(=CC=C1)O)SS(=O)(=O)O |
| InChIKey | OHSVSCINSKAEEK-UHFFFAOYSA-N |
The XLogP value of -1.6 indicates that Thiosulfuric acid, S-(2-(ethylamino)-1-(3-hydroxyphenyl)ethyl) ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiosulfuric acid, S-(2-(ethylamino)-1-(3-hydroxyphenyl)ethyl) ester. Following Lipinski's Rule of Five, Thiosulfuric acid, S-(2-(ethylamino)-1-(3-hydroxyphenyl)ethyl) ester has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Thiosulfuric acid, S-(2-(ethylamino)-1-(3-hydroxyphenyl)ethyl) ester is 119610-63-8.
The molecular formula of Thiosulfuric acid, S-(2-(ethylamino)-1-(3-hydroxyphenyl)ethyl) ester is C10H15NO4S2.
The molecular weight of Thiosulfuric acid, S-(2-(ethylamino)-1-(3-hydroxyphenyl)ethyl) ester is 277.04425 g/mol.
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