S-(4-Chlorophenyl) methanesulfonothioate
TL;DR: S-(4-Chlorophenyl) methanesulfonothioate (CAS 1200-28-8) is a chemical compound with molecular formula C7H7ClO2S2 and molecular weight 221.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-methylsulfonylsulfanylbenzene
Also Known As: S-(4-Chlorophenyl) methanesulfonothioate, 1-chloro-4-methylsulfonylsulfanylbenzene, p-Chlorphenyl-methanthiosulfonat, 1-chloro-4-methylsulfonylsulfanyl-benzene, NCI60_003826
| Molecular Formula | C7H7ClO2S2 |
|---|---|
| Molecular Weight | 221.96 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.9576 |
| Heavy Atoms | 12 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 1200-28-8 |
|---|---|
| SMILES | CS(=O)(=O)SC1=CC=C(C=C1)Cl |
| InChIKey | HRDUILPJXCHZPN-UHFFFAOYSA-N |
Product Overview
S-(4-Chlorophenyl) methanesulfonothioate (CAS 1200-28-8), with molecular formula C7H7ClO2S2 and molecular weight 221.96 g/mol. IUPAC: 1-chloro-4-methylsulfonylsulfanylbenzene.
Chemical Property Profile of S-(4-Chlorophenyl) methanesulfonothioate
Property Insights of S-(4-Chlorophenyl) methanesulfonothioate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(4-Chlorophenyl) methanesulfonothioate. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(4-Chlorophenyl) methanesulfonothioate. Following Lipinski's Rule of Five, S-(4-Chlorophenyl) methanesulfonothioate 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
Frequently Asked Questions
What is the CAS number of S-(4-Chlorophenyl) methanesulfonothioate?
The CAS number of S-(4-Chlorophenyl) methanesulfonothioate is 1200-28-8.
What is the molecular formula of S-(4-Chlorophenyl) methanesulfonothioate?
The molecular formula of S-(4-Chlorophenyl) methanesulfonothioate is C7H7ClO2S2.
What is the molecular weight of S-(4-Chlorophenyl) methanesulfonothioate?
The molecular weight of S-(4-Chlorophenyl) methanesulfonothioate is 221.96 g/mol.
Where can I buy S-(4-Chlorophenyl) methanesulfonothioate?
You can request a quote for S-(4-Chlorophenyl) methanesulfonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(4-Chlorophenyl) methanesulfonothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(4-Chlorophenyl) methanesulfonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.