2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide
TL;DR: 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide (CAS 33356-82-0) is a chemical compound with molecular formula C6H4O5S2 and molecular weight 219.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,1λ6,3λ6-benzoxadithiole 1,1,3,3-tetraoxide
Also Known As: 1,2-benzenedisulfonic anhydride, benzene-1,2-disulfonic anhydride, benzene-1,2-disulfonic acid anhydride, 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide, J1.520.084G
| Molecular Formula | C6H4O5S2 |
|---|---|
| Molecular Weight | 219.95 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 94.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 219.95001 |
| Heavy Atoms | 13 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 33356-82-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)S(=O)(=O)OS2(=O)=O |
| InChIKey | QTLDNGFPYAWPLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide (CAS 33356-82-0), with molecular formula C6H4O5S2 and molecular weight 219.95 g/mol. IUPAC: 2,1λ6,3λ6-benzoxadithiole 1,1,3,3-tetraoxide.
Chemical Property Profile of 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide
Property Insights of 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide. The TPSA of 94.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide. Following Lipinski's Rule of Five, 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide 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 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide?
The CAS number of 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide is 33356-82-0.
What is the molecular formula of 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide?
The molecular formula of 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide is C6H4O5S2.
What is the molecular weight of 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide?
The molecular weight of 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide is 219.95 g/mol.
Where can I buy 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide?
You can request a quote for 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide?
Yes, KEHONG BIO provides custom synthesis services for 2,1,3-Benzoxadithiole, 1,1,3,3-tetraoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.