3,4-Dichlorosulfolane
TL;DR: 3,4-Dichlorosulfolane (CAS 3001-57-8) is a chemical compound with molecular formula C4H6Cl2O2S and molecular weight 187.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dichlorothiolane 1,1-dioxide
Also Known As: 3,4-Dichlorosulfolane, DAC PRD, DAC PRO, Dichlorothiolane dioxide, PRD experimental nematocide
| Molecular Formula | C4H6Cl2O2S |
|---|---|
| Molecular Weight | 187.95 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 187.94655 |
| Heavy Atoms | 9 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 3001-57-8 |
|---|---|
| SMILES | C1C(C(CS1(=O)=O)Cl)Cl |
| InChIKey | JCUQWSIALJCIEE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dichlorosulfolane (CAS 3001-57-8), with molecular formula C4H6Cl2O2S and molecular weight 187.95 g/mol. IUPAC: 3,4-dichlorothiolane 1,1-dioxide.
Chemical Property Profile of 3,4-Dichlorosulfolane
Property Insights of 3,4-Dichlorosulfolane
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dichlorosulfolane. With a topological polar surface area (TPSA) of 42.5 Ų, 3,4-Dichlorosulfolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dichlorosulfolane has 0 hydrogen bond donor(s) and 2 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 3,4-Dichlorosulfolane?
The CAS number of 3,4-Dichlorosulfolane is 3001-57-8.
What is the molecular formula of 3,4-Dichlorosulfolane?
The molecular formula of 3,4-Dichlorosulfolane is C4H6Cl2O2S.
What is the molecular weight of 3,4-Dichlorosulfolane?
The molecular weight of 3,4-Dichlorosulfolane is 187.95 g/mol.
Where can I buy 3,4-Dichlorosulfolane?
You can request a quote for 3,4-Dichlorosulfolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dichlorosulfolane?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dichlorosulfolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.