Hydroxydiiodophenylpyruvic acid
TL;DR: Hydroxydiiodophenylpyruvic acid (CAS 780-00-7) is a chemical compound with molecular formula C9H6I2O4 and molecular weight 431.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-hydroxy-3,5-diiodophenyl)-2-oxopropanoic acid
Also Known As: 3,5-DIIODO-4-HYDROXYPHENYLPYRUVIC ACID, 3-(4-hydroxy-3,5-diiodophenyl)-2-oxopropanoic acid, Hydroxydiiodophenylpyruvic acid, 3,5-Diiodo-4-hydroxyphenylpyruvate, 3-(3,5-Diiodo-4-hydroxyphenyl)pyruvate
| Molecular Formula | C9H6I2O4 |
|---|---|
| Molecular Weight | 431.84 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 431.83554 |
| Heavy Atoms | 15 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 780-00-7 |
|---|---|
| SMILES | C1=C(C=C(C(=C1I)O)I)CC(=O)C(=O)O |
| InChIKey | TZPLBTUUWSVGCY-UHFFFAOYSA-N |
Product Overview
Hydroxydiiodophenylpyruvic acid (CAS 780-00-7), with molecular formula C9H6I2O4 and molecular weight 431.84 g/mol. IUPAC: 3-(4-hydroxy-3,5-diiodophenyl)-2-oxopropanoic acid.
Chemical Property Profile of Hydroxydiiodophenylpyruvic acid
Property Insights of Hydroxydiiodophenylpyruvic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxydiiodophenylpyruvic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroxydiiodophenylpyruvic acid. Following Lipinski's Rule of Five, Hydroxydiiodophenylpyruvic 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 Hydroxydiiodophenylpyruvic acid?
The CAS number of Hydroxydiiodophenylpyruvic acid is 780-00-7.
What is the molecular formula of Hydroxydiiodophenylpyruvic acid?
The molecular formula of Hydroxydiiodophenylpyruvic acid is C9H6I2O4.
What is the molecular weight of Hydroxydiiodophenylpyruvic acid?
The molecular weight of Hydroxydiiodophenylpyruvic acid is 431.84 g/mol.
Where can I buy Hydroxydiiodophenylpyruvic acid?
You can request a quote for Hydroxydiiodophenylpyruvic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxydiiodophenylpyruvic acid?
Yes, KEHONG BIO provides custom synthesis services for Hydroxydiiodophenylpyruvic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.