3,3'-Sulfonyldibenzenesulfonyl chloride
TL;DR: 3,3'-Sulfonyldibenzenesulfonyl chloride (CAS 96380-91-5) is a chemical compound with molecular formula C12H8Cl2O6S3 and molecular weight 413.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorosulfonylphenyl)sulfonylbenzenesulfonyl chloride
Also Known As: 3,3'-sulfonyldibenzenesulfonyl chloride, Diphenyl Sulfone-3,3'-disulfonyl Chloride, 3-(3-chlorosulfonylphenyl)sulfonylbenzenesulfonyl chloride, Benzenesulfonylchloride, 3,3'-sulfonylbis-, 3,3'-sulfonyldi(benzenesulfonyl chloride)
| Molecular Formula | C12H8Cl2O6S3 |
|---|---|
| Molecular Weight | 413.89 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.88602 |
| Heavy Atoms | 23 |
| Complexity | 669.0 |
Chemical Identifiers
| CAS Number | 96380-91-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)Cl)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)Cl |
| InChIKey | JCIFZSCARAOKME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3'-Sulfonyldibenzenesulfonyl chloride (CAS 96380-91-5), with molecular formula C12H8Cl2O6S3 and molecular weight 413.89 g/mol. IUPAC: 3-(3-chlorosulfonylphenyl)sulfonylbenzenesulfonyl chloride.
Chemical Property Profile of 3,3'-Sulfonyldibenzenesulfonyl chloride
Property Insights of 3,3'-Sulfonyldibenzenesulfonyl chloride
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-Sulfonyldibenzenesulfonyl chloride. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-Sulfonyldibenzenesulfonyl chloride. Following Lipinski's Rule of Five, 3,3'-Sulfonyldibenzenesulfonyl chloride has 0 hydrogen bond donor(s) and 6 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 3,3'-Sulfonyldibenzenesulfonyl chloride?
The CAS number of 3,3'-Sulfonyldibenzenesulfonyl chloride is 96380-91-5.
What is the molecular formula of 3,3'-Sulfonyldibenzenesulfonyl chloride?
The molecular formula of 3,3'-Sulfonyldibenzenesulfonyl chloride is C12H8Cl2O6S3.
What is the molecular weight of 3,3'-Sulfonyldibenzenesulfonyl chloride?
The molecular weight of 3,3'-Sulfonyldibenzenesulfonyl chloride is 413.89 g/mol.
Where can I buy 3,3'-Sulfonyldibenzenesulfonyl chloride?
You can request a quote for 3,3'-Sulfonyldibenzenesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Sulfonyldibenzenesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Sulfonyldibenzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.