cis-1,2-Dithiane-4,5-diol
TL;DR: cis-1,2-Dithiane-4,5-diol (CAS 16096-98-3) is a chemical compound with molecular formula C4H8O2S2 and molecular weight 152.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,5R)-dithiane-4,5-diol
Also Known As: oxidized dithioerythritol, cis-1,2-dithiane-4,5-diol, cyclo-DTE, cis-1,5-diol, DITHIANE DIOL
| Molecular Formula | C4H8O2S2 |
|---|---|
| Molecular Weight | 152.00 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 151.99657 |
| Heavy Atoms | 8 |
| Complexity | 68.0 |
Chemical Identifiers
| CAS Number | 16096-98-3 |
|---|---|
| SMILES | C1[C@H]([C@H](CSS1)O)O |
| InChIKey | YPGMOWHXEQDBBV-ZXZARUISSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
cis-1,2-Dithiane-4,5-diol (CAS 16096-98-3), with molecular formula C4H8O2S2 and molecular weight 152.00 g/mol. IUPAC: (4S,5R)-dithiane-4,5-diol.
Chemical Property Profile of cis-1,2-Dithiane-4,5-diol
Property Insights of cis-1,2-Dithiane-4,5-diol
The XLogP value of -0.6 indicates that cis-1,2-Dithiane-4,5-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for cis-1,2-Dithiane-4,5-diol. Following Lipinski's Rule of Five, cis-1,2-Dithiane-4,5-diol has 2 hydrogen bond donor(s) and 4 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 cis-1,2-Dithiane-4,5-diol?
The CAS number of cis-1,2-Dithiane-4,5-diol is 16096-98-3.
What is the molecular formula of cis-1,2-Dithiane-4,5-diol?
The molecular formula of cis-1,2-Dithiane-4,5-diol is C4H8O2S2.
What is the molecular weight of cis-1,2-Dithiane-4,5-diol?
The molecular weight of cis-1,2-Dithiane-4,5-diol is 152.00 g/mol.
Where can I buy cis-1,2-Dithiane-4,5-diol?
You can request a quote for cis-1,2-Dithiane-4,5-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-1,2-Dithiane-4,5-diol?
Yes, KEHONG BIO provides custom synthesis services for cis-1,2-Dithiane-4,5-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.