1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide
TL;DR: 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide (CAS 4941-84-8) is a chemical compound with molecular formula C6H8O3S and molecular weight 160.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyloxathiine 2,2-dioxide
Also Known As: 4,6-dimethyloxathiine 2,2-dioxide, 4,6-dimethyl-1,2-oxathiine 2,2-dioxide, UHFWZYXXGGLZAS-UHFFFAOYSA-, 2,4-dimethyl-1,3-butadienesultone, 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide
| Molecular Formula | C6H8O3S |
|---|---|
| Molecular Weight | 160.02 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.01941 |
| Heavy Atoms | 10 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 4941-84-8 |
|---|---|
| SMILES | CC1=CC(=CS(=O)(=O)O1)C |
| InChIKey | UHFWZYXXGGLZAS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide (CAS 4941-84-8), with molecular formula C6H8O3S and molecular weight 160.02 g/mol. IUPAC: 4,6-dimethyloxathiine 2,2-dioxide.
Chemical Property Profile of 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide
Property Insights of 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide. With a topological polar surface area (TPSA) of 51.8 Ų, 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Oxathiin, 4,6-dimethyl-, 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 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide?
The CAS number of 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide is 4941-84-8.
What is the molecular formula of 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide?
The molecular formula of 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide is C6H8O3S.
What is the molecular weight of 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide?
The molecular weight of 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide is 160.02 g/mol.
Where can I buy 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide?
You can request a quote for 1,2-Oxathiin, 4,6-dimethyl-, 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 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Oxathiin, 4,6-dimethyl-, 2,2-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.