4,4'-Sulfonylbis(2-chlorophenol)
TL;DR: 4,4'-Sulfonylbis(2-chlorophenol) (CAS 46947-87-9) is a chemical compound with molecular formula C12H8Cl2O4S and molecular weight 317.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-(3-chloro-4-hydroxyphenyl)sulfonylphenol
Also Known As: Dichlorobisphenol S, Dichloro Bisphenol S Isomer, 4,4'-sulfonylbis(2-chlorophenol), 2-chloro-4-(3-chloro-4-hydroxyphenyl)sulfonylphenol, bis(3-chloro-4-hydroxyphenyl)sulfone
| Molecular Formula | C12H8Cl2O4S |
|---|---|
| Molecular Weight | 317.95 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 83.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.95203 |
| Heavy Atoms | 19 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 46947-87-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)C2=CC(=C(C=C2)O)Cl)Cl)O |
| InChIKey | PWDGALQKQJSBKU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-Sulfonylbis(2-chlorophenol) (CAS 46947-87-9), with molecular formula C12H8Cl2O4S and molecular weight 317.95 g/mol. IUPAC: 2-chloro-4-(3-chloro-4-hydroxyphenyl)sulfonylphenol.
Chemical Property Profile of 4,4'-Sulfonylbis(2-chlorophenol)
Property Insights of 4,4'-Sulfonylbis(2-chlorophenol)
The XLogP value of 3.3 indicates that 4,4'-Sulfonylbis(2-chlorophenol) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-Sulfonylbis(2-chlorophenol). Following Lipinski's Rule of Five, 4,4'-Sulfonylbis(2-chlorophenol) has 2 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 4,4'-Sulfonylbis(2-chlorophenol)?
The CAS number of 4,4'-Sulfonylbis(2-chlorophenol) is 46947-87-9.
What is the molecular formula of 4,4'-Sulfonylbis(2-chlorophenol)?
The molecular formula of 4,4'-Sulfonylbis(2-chlorophenol) is C12H8Cl2O4S.
What is the molecular weight of 4,4'-Sulfonylbis(2-chlorophenol)?
The molecular weight of 4,4'-Sulfonylbis(2-chlorophenol) is 317.95 g/mol.
Where can I buy 4,4'-Sulfonylbis(2-chlorophenol)?
You can request a quote for 4,4'-Sulfonylbis(2-chlorophenol) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Sulfonylbis(2-chlorophenol)?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Sulfonylbis(2-chlorophenol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.