TL;DR: 1,2,3,5,6,8-Hexathionane (CAS 103439-80-1) is a chemical compound with molecular formula C3H6S6 and molecular weight 233.87938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,5,6,8-hexathionane
Also Known As: 1,2,3,5,6,8-hexathionane, 1,2,3,5,6,8-hexathiacyclononane
| Molecular Formula | C3H6S6 |
| Molecular Weight | 233.87938 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 152.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 233.87938 Da |
| Heavy Atoms | 9 |
| Complexity | 65.0 |
| SMILES | C1SCSSSCSS1 |
| InChIKey | ZOJCTXCAPUGEKN-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,5,6,8-Hexathionane. The TPSA of 152.0 Ų indicates high polarity, suggesting 1,2,3,5,6,8-Hexathionane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,2,3,5,6,8-Hexathionane has 0 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 1,2,3,5,6,8-Hexathionane is 103439-80-1.
The molecular formula of 1,2,3,5,6,8-Hexathionane is C3H6S6.
The molecular weight of 1,2,3,5,6,8-Hexathionane is 233.87938 g/mol.
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