Hexyl 1,1-dioxothiolane-3-sulfonate
TL;DR: Hexyl 1,1-dioxothiolane-3-sulfonate (CAS 401819-76-9) is a chemical compound with molecular formula C10H20O5S2 and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexyl 1,1-dioxothiolane-3-sulfonate
Also Known As: hexyl 1,1-dioxothiolane-3-sulfonate, 3-hexoxysulfonylthiolane 1,1-dioxide, hexyl tetrahydrothiophene-3-sulfonate 1,1-dioxide
| Molecular Formula | C10H20O5S2 |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 1.1002 |
| Topological Polar Surface Area | 77.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 284.07523 |
| Heavy Atoms | 17 |
| Complexity | 423.6126 |
Chemical Identifiers
| CAS Number | 401819-76-9 |
|---|---|
| SMILES | CCCCCCOS(=O)(=O)C1CCS(=O)(=O)C1 |
Product Overview
Hexyl 1,1-dioxothiolane-3-sulfonate (CAS 401819-76-9), with molecular formula C10H20O5S2 and molecular weight 284.08 g/mol. IUPAC: hexyl 1,1-dioxothiolane-3-sulfonate.
Chemical Property Profile of Hexyl 1,1-dioxothiolane-3-sulfonate
Property Insights of Hexyl 1,1-dioxothiolane-3-sulfonate
The XLogP value of 1.1002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexyl 1,1-dioxothiolane-3-sulfonate. The TPSA of 77.51 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexyl 1,1-dioxothiolane-3-sulfonate. Following Lipinski's Rule of Five, Hexyl 1,1-dioxothiolane-3-sulfonate has 0 hydrogen bond donor(s) and 5 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 Hexyl 1,1-dioxothiolane-3-sulfonate?
The CAS number of Hexyl 1,1-dioxothiolane-3-sulfonate is 401819-76-9.
What is the molecular formula of Hexyl 1,1-dioxothiolane-3-sulfonate?
The molecular formula of Hexyl 1,1-dioxothiolane-3-sulfonate is C10H20O5S2.
What is the molecular weight of Hexyl 1,1-dioxothiolane-3-sulfonate?
The molecular weight of Hexyl 1,1-dioxothiolane-3-sulfonate is 284.08 g/mol.
Where can I buy Hexyl 1,1-dioxothiolane-3-sulfonate?
You can request a quote for Hexyl 1,1-dioxothiolane-3-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexyl 1,1-dioxothiolane-3-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for Hexyl 1,1-dioxothiolane-3-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.