5-nonyl-5H-oxathiole 2,2-dioxide
TL;DR: 5-nonyl-5H-oxathiole 2,2-dioxide (CAS 6335-98-4) is a chemical compound with molecular formula C12H22O3S and molecular weight 246.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nonyl-5H-oxathiole 2,2-dioxide
Also Known As: 5-nonyl-5H-oxathiole 2,2-dioxide, 1-dodecene-1,3-sultone, 5H-Oxathiole, 5-nonyl-, 2,2-dioxide, 5-nonyl-5h-1,2-oxathiole 2,2-dioxide, 5H-Oxathiole,5-nonyl-,2,2-dioxide
| Molecular Formula | C12H22O3S |
|---|---|
| Molecular Weight | 246.13 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 246.12897 |
| Heavy Atoms | 16 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 6335-98-4 |
|---|---|
| SMILES | CCCCCCCCCC1C=CS(=O)(=O)O1 |
| InChIKey | QHJNAOSQANTVGN-UHFFFAOYSA-N |
Product Overview
5-nonyl-5H-oxathiole 2,2-dioxide (CAS 6335-98-4), with molecular formula C12H22O3S and molecular weight 246.13 g/mol. IUPAC: 5-nonyl-5H-oxathiole 2,2-dioxide.
Chemical Property Profile of 5-nonyl-5H-oxathiole 2,2-dioxide
Property Insights of 5-nonyl-5H-oxathiole 2,2-dioxide
The XLogP value of 4.2 indicates that 5-nonyl-5H-oxathiole 2,2-dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 5-nonyl-5H-oxathiole 2,2-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-nonyl-5H-oxathiole 2,2-dioxide has 0 hydrogen bond donor(s) and 3 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 5-nonyl-5H-oxathiole 2,2-dioxide?
The CAS number of 5-nonyl-5H-oxathiole 2,2-dioxide is 6335-98-4.
What is the molecular formula of 5-nonyl-5H-oxathiole 2,2-dioxide?
The molecular formula of 5-nonyl-5H-oxathiole 2,2-dioxide is C12H22O3S.
What is the molecular weight of 5-nonyl-5H-oxathiole 2,2-dioxide?
The molecular weight of 5-nonyl-5H-oxathiole 2,2-dioxide is 246.13 g/mol.
Where can I buy 5-nonyl-5H-oxathiole 2,2-dioxide?
You can request a quote for 5-nonyl-5H-oxathiole 2,2-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-nonyl-5H-oxathiole 2,2-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 5-nonyl-5H-oxathiole 2,2-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.