3,5-Diamino-4-chlorobenzenesulfonic acid
TL;DR: 3,5-Diamino-4-chlorobenzenesulfonic acid (CAS 7057-68-3) is a chemical compound with molecular formula C6H7ClN2O3S and molecular weight 221.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-diamino-4-chlorobenzenesulfonic acid
Also Known As: 3,5-diamino-4-chlorobenzenesulfonic acid, Benzenesulfonic acid, 3,5-diamino-4-chloro-, 3,5-Diamino-4-chlorobenzenesulphonic acid, 3,5-Diamino-4-chlorobenzene-1-sulfonic acid, 3,5-Diamino-4-chlorobenzene sulfonic acid
| Molecular Formula | C6H7ClN2O3S |
|---|---|
| Molecular Weight | 221.99 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.98659 |
| Heavy Atoms | 13 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 7057-68-3 |
|---|---|
| SMILES | C1=C(C=C(C(=C1N)Cl)N)S(=O)(=O)O |
| InChIKey | PIJNMVNHBRSTEJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Diamino-4-chlorobenzenesulfonic acid (CAS 7057-68-3), with molecular formula C6H7ClN2O3S and molecular weight 221.99 g/mol. IUPAC: 3,5-diamino-4-chlorobenzenesulfonic acid.
Chemical Property Profile of 3,5-Diamino-4-chlorobenzenesulfonic acid
Property Insights of 3,5-Diamino-4-chlorobenzenesulfonic acid
The XLogP value of -0.1 indicates that 3,5-Diamino-4-chlorobenzenesulfonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Diamino-4-chlorobenzenesulfonic acid. Following Lipinski's Rule of Five, 3,5-Diamino-4-chlorobenzenesulfonic acid has 3 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 3,5-Diamino-4-chlorobenzenesulfonic acid?
The CAS number of 3,5-Diamino-4-chlorobenzenesulfonic acid is 7057-68-3.
What is the molecular formula of 3,5-Diamino-4-chlorobenzenesulfonic acid?
The molecular formula of 3,5-Diamino-4-chlorobenzenesulfonic acid is C6H7ClN2O3S.
What is the molecular weight of 3,5-Diamino-4-chlorobenzenesulfonic acid?
The molecular weight of 3,5-Diamino-4-chlorobenzenesulfonic acid is 221.99 g/mol.
Where can I buy 3,5-Diamino-4-chlorobenzenesulfonic acid?
You can request a quote for 3,5-Diamino-4-chlorobenzenesulfonic 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-Diamino-4-chlorobenzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Diamino-4-chlorobenzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.