Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester
TL;DR: Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester (CAS 1146-44-7) is a chemical compound with molecular formula C12H8Cl2O2S2 and molecular weight 317.93427 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-4-(4-chlorophenyl)sulfonylsulfanylbenzene
Also Known As: S-(4-Chlorophenyl) 4-chlorobenzenesulfonothioate, 1-chloro-4-(4-chlorophenyl)sulfonylsulfanylbenzene, Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester, p-Chlorophenylthio p-chlorophenyl sulfone, NCI60_003715
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H8Cl2O2S2 |
| Molecular Weight | 317.93427 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 67.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 317.93427 Da |
| Heavy Atoms | 18 |
| Complexity | 351.0 |
| SMILES | C1=CC(=CC=C1SS(=O)(=O)C2=CC=C(C=C2)Cl)Cl |
| InChIKey | HKRKZYSYVNYGRL-UHFFFAOYSA-N |
Chemical Property Profile of Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester
Property Insights of Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester
The XLogP value of 4.4 indicates that Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester. Following Lipinski's Rule of Five, Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester 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
What is the CAS number of Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester?
The CAS number of Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester is 1146-44-7.
What is the molecular formula of Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester?
The molecular formula of Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester is C12H8Cl2O2S2.
What is the molecular weight of Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester?
The molecular weight of Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester is 317.93427 g/mol.
Where can I buy Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester?
You can request a quote for Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester?
Yes, CoreyChem provides custom synthesis services for Benzenesulfonic acid, p-chlorothio-, S-(p-chlorophenyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.