1,3-Benzenedisulfonyl dichloride
TL;DR: 1,3-Benzenedisulfonyl dichloride (CAS 585-47-7) is a chemical compound with molecular formula C6H4Cl2O4S2 and molecular weight 273.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-disulfonyl chloride
Also Known As: 1,3-Benzenedisulfonyl chloride, Benzene-1,3-disulfonyl dichloride, 1,3-Benzenedisulfonyl dichloride, Benzene-1,3-disulfonyl chloride, m-Benzenedisulfonyl chloride
| Molecular Formula | C6H4Cl2O4S2 |
|---|---|
| Molecular Weight | 273.89 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 85.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.8928 |
| Heavy Atoms | 14 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 585-47-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)Cl)S(=O)(=O)Cl |
| InChIKey | ALIQZUMMPOYCIS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Benzenedisulfonyl dichloride (CAS 585-47-7), with molecular formula C6H4Cl2O4S2 and molecular weight 273.89 g/mol. IUPAC: benzene-1,3-disulfonyl chloride.
Chemical Property Profile of 1,3-Benzenedisulfonyl dichloride
Property Insights of 1,3-Benzenedisulfonyl dichloride
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Benzenedisulfonyl dichloride. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Benzenedisulfonyl dichloride. Following Lipinski's Rule of Five, 1,3-Benzenedisulfonyl dichloride has 0 hydrogen bond donor(s) and 4 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 1,3-Benzenedisulfonyl dichloride?
The CAS number of 1,3-Benzenedisulfonyl dichloride is 585-47-7.
What is the molecular formula of 1,3-Benzenedisulfonyl dichloride?
The molecular formula of 1,3-Benzenedisulfonyl dichloride is C6H4Cl2O4S2.
What is the molecular weight of 1,3-Benzenedisulfonyl dichloride?
The molecular weight of 1,3-Benzenedisulfonyl dichloride is 273.89 g/mol.
Where can I buy 1,3-Benzenedisulfonyl dichloride?
You can request a quote for 1,3-Benzenedisulfonyl dichloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenedisulfonyl dichloride?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenedisulfonyl dichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.