Ioxynic acid
TL;DR: Ioxynic acid (CAS 618-76-8) is a chemical compound with molecular formula C7H4I2O3 and molecular weight 389.82 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-3,5-diiodobenzoic acid
Also Known As: 4-Hydroxy-3,5-diiodobenzoic acid, 3,5-Diiodo-4-hydroxybenzoic acid, Ioxynic acid, Ioxynil acid, Ioxynil metabolite
| Molecular Formula | C7H4I2O3 |
|---|---|
| Molecular Weight | 389.82 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 389.82498 |
| Heavy Atoms | 12 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 618-76-8 |
|---|---|
| SMILES | C1=C(C=C(C(=C1I)O)I)C(=O)O |
| InChIKey | XREKTVACBXQCSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ioxynic acid (CAS 618-76-8), with molecular formula C7H4I2O3 and molecular weight 389.82 g/mol. IUPAC: 4-hydroxy-3,5-diiodobenzoic acid.
Chemical Property Profile of Ioxynic acid
Property Insights of Ioxynic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ioxynic acid. With a topological polar surface area (TPSA) of 57.5 Ų, Ioxynic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ioxynic acid has 2 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 Ioxynic acid?
The CAS number of Ioxynic acid is 618-76-8.
What is the molecular formula of Ioxynic acid?
The molecular formula of Ioxynic acid is C7H4I2O3.
What is the molecular weight of Ioxynic acid?
The molecular weight of Ioxynic acid is 389.82 g/mol.
Where can I buy Ioxynic acid?
You can request a quote for Ioxynic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ioxynic acid?
Yes, KEHONG BIO provides custom synthesis services for Ioxynic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.