3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid
TL;DR: 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid (CAS 428501-72-8) is a chemical compound with molecular formula C17H15IO5 and molecular weight 426.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-ethoxy-4-formyl-6-iodophenoxy)methyl]benzoic acid
Also Known As: ACID, starbld0010972, 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid, 3-[(2-ethoxy-4-formyl-6-iodophenoxy)methyl]benzoic acid, SP695
| Molecular Formula | C17H15IO5 |
|---|---|
| Molecular Weight | 426.00 g/mol |
| LogP | 3.7796 |
| Topological Polar Surface Area | 72.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 425.99643 |
| Heavy Atoms | 23 |
| Complexity | 726.9188 |
Chemical Identifiers
| CAS Number | 428501-72-8 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C=O)I)OCC2=CC(=CC=C2)C(=O)O |
Product Overview
3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid (CAS 428501-72-8), with molecular formula C17H15IO5 and molecular weight 426.00 g/mol. IUPAC: 3-[(2-ethoxy-4-formyl-6-iodophenoxy)methyl]benzoic acid.
Chemical Property Profile of 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid
Property Insights of 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid
The XLogP value of 3.7796 indicates that 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid. Following Lipinski's Rule of Five, 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid has 1 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 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid?
The CAS number of 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid is 428501-72-8.
What is the molecular formula of 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid?
The molecular formula of 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid is C17H15IO5.
What is the molecular weight of 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid?
The molecular weight of 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid is 426.00 g/mol.
Where can I buy 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid?
You can request a quote for 3-((2-Ethoxy-4-formyl-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 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((2-Ethoxy-4-formyl-6-iodophenoxy)methyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.