1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol
TL;DR: 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol (CAS 500554-91-6) is a chemical compound with molecular formula C4H8O6S2 and molecular weight 215.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,3,3-tetraoxo-1,3-dithiane-5,5-diol
Also Known As: 1,1,3,3-tetraoxo-1,3-dithiane-5,5-diol, 1,3-dithiane-5,5-diol 1,1,3,3-tetraoxide, 1,3-Dithiane-5,5-diol,1,1,3,3-tetraoxide, 1,3-Dithiane-5,5-diol, 1,1,3,3-tetraoxide (9CI)
| Molecular Formula | C4H8O6S2 |
|---|---|
| Molecular Weight | 215.98 g/mol |
| LogP | -2.5 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 215.97623 |
| Heavy Atoms | 12 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 500554-91-6 |
|---|---|
| SMILES | C1C(CS(=O)(=O)CS1(=O)=O)(O)O |
| InChIKey | CZJJLJZPCBCYAD-UHFFFAOYSA-N |
Product Overview
1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol (CAS 500554-91-6), with molecular formula C4H8O6S2 and molecular weight 215.98 g/mol. IUPAC: 1,1,3,3-tetraoxo-1,3-dithiane-5,5-diol.
Chemical Property Profile of 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol
Property Insights of 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol
The XLogP value of -2.5 indicates that 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol. Following Lipinski's Rule of Five, 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol?
The CAS number of 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol is 500554-91-6.
What is the molecular formula of 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol?
The molecular formula of 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol is C4H8O6S2.
What is the molecular weight of 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol?
The molecular weight of 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol is 215.98 g/mol.
Where can I buy 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol?
You can request a quote for 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol?
Yes, KEHONG BIO provides custom synthesis services for 1,1,3,3-Tetraoxo-1,3-dithiane-5,5-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.