3,5-二氯-4-羟基苯磺酸
TL;DR: 3,5-二氯-4-羟基苯磺酸 (CAS 25319-98-6) 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.
3,5-二氯-4-羟基苯磺酸
3,5-dichloro-4-hydroxybenzenesulfonic acid
Also Known As: 3,5-dichloro-4-hydroxybenzenesulfonic acid, 3,5-Dichloro-4-hydroxybenzenesulphonic acid, 3,5-Dichloro-4-Hydroxybenzene-1-Sulfonic Acid, 3,5-dichloro-4-hydroxybenzenesulphonicacid, 3,5-dichloro-4-hydroxy-benzenesulfonic acid
| Molecular Formula | C6H4Cl2O4S |
|---|---|
| Molecular Weight | 241.92 g/mol |
| LogP | 1.8 |
| 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 | 261.0 |
Chemical Identifiers
| CAS Number | 25319-98-6 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Cl)O)Cl)S(=O)(=O)O |
| InChIKey | PGDCAFRJYQICAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-二氯-4-羟基苯磺酸 (CAS 25319-98-6), with molecular formula C6H4Cl2O4S and molecular weight 241.92 g/mol. IUPAC: 3,5-dichloro-4-hydroxybenzenesulfonic acid.
Chemical Property Profile of 3,5-二氯-4-羟基苯磺酸
Property Insights of 3,5-二氯-4-羟基苯磺酸
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-二氯-4-羟基苯磺酸. The TPSA of 83.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-二氯-4-羟基苯磺酸. Following Lipinski's Rule of Five, 3,5-二氯-4-羟基苯磺酸 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 3,5-二氯-4-羟基苯磺酸?
The CAS number of 3,5-二氯-4-羟基苯磺酸 is 25319-98-6.
What is the molecular formula of 3,5-二氯-4-羟基苯磺酸?
The molecular formula of 3,5-二氯-4-羟基苯磺酸 is C6H4Cl2O4S.
What is the molecular weight of 3,5-二氯-4-羟基苯磺酸?
The molecular weight of 3,5-二氯-4-羟基苯磺酸 is 241.92 g/mol.
Where can I buy 3,5-二氯-4-羟基苯磺酸?
You can request a quote for 3,5-二氯-4-羟基苯磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-二氯-4-羟基苯磺酸?
Yes, KEHONG BIO provides custom synthesis services for 3,5-二氯-4-羟基苯磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.