Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate
TL;DR: Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate (CAS 202191-29-5) is a chemical compound with molecular formula C14H13ClO5S2 and molecular weight 359.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate
Also Known As: phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate, phenyl 2-[(4-chlorophenyl)sulfonyl]ethanesulfonate, Phenyl 2-(4-chlorobenzene-1-sulfonyl)ethane-1-sulfonate, 2-(4-chloro-benzenesulfonyl)-ethanesulfonic acid phenyl ester
| Molecular Formula | C14H13ClO5S2 |
|---|---|
| Molecular Weight | 359.99 g/mol |
| LogP | 2.5225 |
| Topological Polar Surface Area | 77.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.9893 |
| Heavy Atoms | 22 |
| Complexity | 828.56177 |
Chemical Identifiers
| CAS Number | 202191-29-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)OS(=O)(=O)CCS(=O)(=O)C2=CC=C(C=C2)Cl |
Product Overview
Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate (CAS 202191-29-5), with molecular formula C14H13ClO5S2 and molecular weight 359.99 g/mol. IUPAC: phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate.
Chemical Property Profile of Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate
Property Insights of Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate
The XLogP value of 2.5225 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate. The TPSA of 77.51 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate. Following Lipinski's Rule of Five, Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate has 0 hydrogen bond donor(s) and 5 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 Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate?
The CAS number of Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate is 202191-29-5.
What is the molecular formula of Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate?
The molecular formula of Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate is C14H13ClO5S2.
What is the molecular weight of Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate?
The molecular weight of Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate is 359.99 g/mol.
Where can I buy Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate?
You can request a quote for Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 2-(4-chlorophenyl)sulfonylethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.