3,5-Dichloro-2-hydroxybenzenesulfonic acid
TL;DR: 3,5-Dichloro-2-hydroxybenzenesulfonic acid (CAS 54970-72-8) is a chemical compound with molecular formula C6H4Cl2O4S and molecular weight 241.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dichloro-2-hydroxybenzenesulfonic acid
Also Known As: 3,5-Dichloro-2-hydroxybenzenesulfonic acid, DCHBS, DHBS, HDCBS, Benzenesulfonic acid, 3,5-dichloro-2-hydroxy-
| Molecular Formula | C6H4Cl2O4S |
|---|---|
| Molecular Weight | 241.92 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 83.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 241.92073 |
| Heavy Atoms | 13 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 54970-72-8 |
|---|---|
| SMILES | C1=C(C=C(C(=C1S(=O)(=O)O)O)Cl)Cl |
| InChIKey | LWKJNIMGNUTZOO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Dichloro-2-hydroxybenzenesulfonic acid (CAS 54970-72-8), with molecular formula C6H4Cl2O4S and molecular weight 241.92 g/mol. IUPAC: 3,5-dichloro-2-hydroxybenzenesulfonic acid.
Chemical Property Profile of 3,5-Dichloro-2-hydroxybenzenesulfonic acid
Property Insights of 3,5-Dichloro-2-hydroxybenzenesulfonic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dichloro-2-hydroxybenzenesulfonic acid. The TPSA of 83.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dichloro-2-hydroxybenzenesulfonic acid. Following Lipinski's Rule of Five, 3,5-Dichloro-2-hydroxybenzenesulfonic acid 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 3,5-Dichloro-2-hydroxybenzenesulfonic acid?
The CAS number of 3,5-Dichloro-2-hydroxybenzenesulfonic acid is 54970-72-8.
What is the molecular formula of 3,5-Dichloro-2-hydroxybenzenesulfonic acid?
The molecular formula of 3,5-Dichloro-2-hydroxybenzenesulfonic acid is C6H4Cl2O4S.
What is the molecular weight of 3,5-Dichloro-2-hydroxybenzenesulfonic acid?
The molecular weight of 3,5-Dichloro-2-hydroxybenzenesulfonic acid is 241.92 g/mol.
Where can I buy 3,5-Dichloro-2-hydroxybenzenesulfonic acid?
You can request a quote for 3,5-Dichloro-2-hydroxybenzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dichloro-2-hydroxybenzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dichloro-2-hydroxybenzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.