![4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid structure](/static/products/6938/693821-94-2.webp)
4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid
TL;DR: 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid (CAS 693821-94-2) is a chemical compound with molecular formula C17H17IO5 and molecular weight 428.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl]benzoic acid
Also Known As: AH-487/41800919, 4-{[2-ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid, 4-[[2-ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl]benzoic acid, 4-((2-ethoxy-4-(hydroxymethyl)-6-iodophenoxy)methyl)benzoic acid
| Molecular Formula | C17H17IO5 |
|---|---|
| Molecular Weight | 428.01 g/mol |
| LogP | 3.4594 |
| Topological Polar Surface Area | 75.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 428.0121 |
| Heavy Atoms | 23 |
| Complexity | 682.12823 |
Chemical Identifiers
| CAS Number | 693821-94-2 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)CO)I)OCC2=CC=C(C=C2)C(=O)O |
Product Overview
4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid (CAS 693821-94-2), with molecular formula C17H17IO5 and molecular weight 428.01 g/mol. IUPAC: 4-[[2-ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl]benzoic acid.
Chemical Property Profile of 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid
Property Insights of 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid
The XLogP value of 3.4594 indicates that 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid. Following Lipinski's Rule of Five, 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic 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 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid?
The CAS number of 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid is 693821-94-2.
What is the molecular formula of 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid?
The molecular formula of 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid is C17H17IO5.
What is the molecular weight of 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid?
The molecular weight of 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid is 428.01 g/mol.
Where can I buy 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid?
You can request a quote for 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[2-Ethoxy-4-(hydroxymethyl)-6-iodophenoxy]methyl}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.