4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester
TL;DR: 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester (CAS 7403-25-0) is a chemical compound with molecular formula C12H7Cl3O3S and molecular weight 335.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dichlorophenyl) 4-chlorobenzenesulfonate
Also Known As: NCIOpen2_007553, (2,4-dichlorophenyl) 4-chlorobenzenesulfonate, Benzenesulfonic acid, p-chloro-, 2,4-dichlorophenyl ester, (2,4-dichlorophenyl)4-chlorobenzenesulfonate, 2,4-Dichlorophenyl 4-chlorobenzene-1-sulfonate
| Molecular Formula | C12H7Cl3O3S |
|---|---|
| Molecular Weight | 335.92 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.91815 |
| Heavy Atoms | 19 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 7403-25-0 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)OC2=C(C=C(C=C2)Cl)Cl)Cl |
| InChIKey | GVMHORIVFUXONX-UHFFFAOYSA-N |
Product Overview
4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester (CAS 7403-25-0), with molecular formula C12H7Cl3O3S and molecular weight 335.92 g/mol. IUPAC: (2,4-dichlorophenyl) 4-chlorobenzenesulfonate.
Chemical Property Profile of 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester
Property Insights of 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester
The XLogP value of 4.9 indicates that 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl 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
Frequently Asked Questions
What is the CAS number of 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester?
The CAS number of 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester is 7403-25-0.
What is the molecular formula of 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester?
The molecular formula of 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester is C12H7Cl3O3S.
What is the molecular weight of 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester?
The molecular weight of 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester is 335.92 g/mol.
Where can I buy 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester?
You can request a quote for 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-benzenesulfonic acid 2,4-dichloro-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.