o-Phenolsulfonic acid
TL;DR: o-Phenolsulfonic acid (CAS 609-46-1) is a chemical compound with molecular formula C6H6O4S and molecular weight 174.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxybenzenesulfonic acid
Also Known As: 2-Hydroxybenzenesulfonic acid, O-PHENOLSULFONIC ACID, phenolsulfonic acid, Phenol-2-sulfonic acid, 2-sulfophenol
| Molecular Formula | C6H6O4S |
|---|---|
| Molecular Weight | 174.00 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 83.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.99867 |
| Heavy Atoms | 11 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 609-46-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)O)S(=O)(=O)O |
| InChIKey | IULJSGIJJZZUMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
o-Phenolsulfonic acid (CAS 609-46-1), with molecular formula C6H6O4S and molecular weight 174.00 g/mol. IUPAC: 2-hydroxybenzenesulfonic acid.
Chemical Property Profile of o-Phenolsulfonic acid
Property Insights of o-Phenolsulfonic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for o-Phenolsulfonic acid. The TPSA of 83.0 Ų falls within the moderate polarity range, balancing permeability and solubility for o-Phenolsulfonic acid. Following Lipinski's Rule of Five, o-Phenolsulfonic 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 o-Phenolsulfonic acid?
The CAS number of o-Phenolsulfonic acid is 609-46-1.
What is the molecular formula of o-Phenolsulfonic acid?
The molecular formula of o-Phenolsulfonic acid is C6H6O4S.
What is the molecular weight of o-Phenolsulfonic acid?
The molecular weight of o-Phenolsulfonic acid is 174.00 g/mol.
Where can I buy o-Phenolsulfonic acid?
You can request a quote for o-Phenolsulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-Phenolsulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for o-Phenolsulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.