1,1-Dioxothiolan-3-yl nonylsulfonate
TL;DR: 1,1-Dioxothiolan-3-yl nonylsulfonate (CAS 507256-72-6) is a chemical compound with molecular formula C13H26O5S2 and molecular weight 326.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,1-dioxothiolan-3-yl) nonane-1-sulfonate
Also Known As: 1,1-dioxothiolan-3-yl nonylsulfonate, 3-nonylsulfonyloxythiolane 1,1-dioxide, (1,1-dioxothiolan-3-yl) nonane-1-sulfonate, 1,1-dioxidotetrahydro-3-thienyl nonane-1-sulfonate
| Molecular Formula | C13H26O5S2 |
|---|---|
| Molecular Weight | 326.12 g/mol |
| LogP | 2.2705 |
| Topological Polar Surface Area | 77.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 326.12216 |
| Heavy Atoms | 20 |
| Complexity | 466.99 |
Chemical Identifiers
| CAS Number | 507256-72-6 |
|---|---|
| SMILES | CCCCCCCCCS(=O)(=O)OC1CCS(=O)(=O)C1 |
Product Overview
1,1-Dioxothiolan-3-yl nonylsulfonate (CAS 507256-72-6), with molecular formula C13H26O5S2 and molecular weight 326.12 g/mol. IUPAC: (1,1-dioxothiolan-3-yl) nonane-1-sulfonate.
Chemical Property Profile of 1,1-Dioxothiolan-3-yl nonylsulfonate
Property Insights of 1,1-Dioxothiolan-3-yl nonylsulfonate
The XLogP value of 2.2705 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Dioxothiolan-3-yl nonylsulfonate. The TPSA of 77.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1-Dioxothiolan-3-yl nonylsulfonate. Following Lipinski's Rule of Five, 1,1-Dioxothiolan-3-yl nonylsulfonate 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 1,1-Dioxothiolan-3-yl nonylsulfonate?
The CAS number of 1,1-Dioxothiolan-3-yl nonylsulfonate is 507256-72-6.
What is the molecular formula of 1,1-Dioxothiolan-3-yl nonylsulfonate?
The molecular formula of 1,1-Dioxothiolan-3-yl nonylsulfonate is C13H26O5S2.
What is the molecular weight of 1,1-Dioxothiolan-3-yl nonylsulfonate?
The molecular weight of 1,1-Dioxothiolan-3-yl nonylsulfonate is 326.12 g/mol.
Where can I buy 1,1-Dioxothiolan-3-yl nonylsulfonate?
You can request a quote for 1,1-Dioxothiolan-3-yl nonylsulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dioxothiolan-3-yl nonylsulfonate?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dioxothiolan-3-yl nonylsulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.