Thiolane-3,4-diyl dimethanesulfonate
TL;DR: Thiolane-3,4-diyl dimethanesulfonate (CAS 40227-22-3) is a chemical compound with molecular formula C6H12O6S3 and molecular weight 275.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylsulfonyloxythiolan-3-yl) methanesulfonate
Also Known As: Thiolane-3,4-diyl dimethanesulfonate, (4-methylsulfonyloxythiolan-3-yl) methanesulfonate
| Molecular Formula | C6H12O6S3 |
|---|---|
| Molecular Weight | 275.98 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.9796 |
| Heavy Atoms | 15 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 40227-22-3 |
|---|---|
| SMILES | CS(=O)(=O)OC1CSCC1OS(=O)(=O)C |
| InChIKey | JSNYADYCZPEMMY-UHFFFAOYSA-N |
Product Overview
Thiolane-3,4-diyl dimethanesulfonate (CAS 40227-22-3), with molecular formula C6H12O6S3 and molecular weight 275.98 g/mol. IUPAC: (4-methylsulfonyloxythiolan-3-yl) methanesulfonate.
Chemical Property Profile of Thiolane-3,4-diyl dimethanesulfonate
Property Insights of Thiolane-3,4-diyl dimethanesulfonate
The XLogP value of -0.4 indicates that Thiolane-3,4-diyl dimethanesulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiolane-3,4-diyl dimethanesulfonate. Following Lipinski's Rule of Five, Thiolane-3,4-diyl dimethanesulfonate has 0 hydrogen bond donor(s) and 7 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 Thiolane-3,4-diyl dimethanesulfonate?
The CAS number of Thiolane-3,4-diyl dimethanesulfonate is 40227-22-3.
What is the molecular formula of Thiolane-3,4-diyl dimethanesulfonate?
The molecular formula of Thiolane-3,4-diyl dimethanesulfonate is C6H12O6S3.
What is the molecular weight of Thiolane-3,4-diyl dimethanesulfonate?
The molecular weight of Thiolane-3,4-diyl dimethanesulfonate is 275.98 g/mol.
Where can I buy Thiolane-3,4-diyl dimethanesulfonate?
You can request a quote for Thiolane-3,4-diyl dimethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiolane-3,4-diyl dimethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Thiolane-3,4-diyl dimethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.