3,4-Diethoxy-5-iodobenzoic acid
TL;DR: 3,4-Diethoxy-5-iodobenzoic acid (CAS 712294-47-8) is a chemical compound with molecular formula C11H13IO4 and molecular weight 335.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-diethoxy-5-iodobenzoic acid
Also Known As: 3,4-diethoxy-5-iodobenzoic acid, 3,4-diethoxy-5-iodo-benzoic acid, AH-487/42820061
| Molecular Formula | C11H13IO4 |
|---|---|
| Molecular Weight | 335.99 g/mol |
| LogP | 2.7868 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.98587 |
| Heavy Atoms | 16 |
| Complexity | 389.8161 |
Chemical Identifiers
| CAS Number | 712294-47-8 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C(=O)O)I)OCC |
Product Overview
3,4-Diethoxy-5-iodobenzoic acid (CAS 712294-47-8), with molecular formula C11H13IO4 and molecular weight 335.99 g/mol. IUPAC: 3,4-diethoxy-5-iodobenzoic acid.
Chemical Property Profile of 3,4-Diethoxy-5-iodobenzoic acid
Property Insights of 3,4-Diethoxy-5-iodobenzoic acid
The XLogP value of 2.7868 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Diethoxy-5-iodobenzoic acid. With a topological polar surface area (TPSA) of 55.76 Ų, 3,4-Diethoxy-5-iodobenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Diethoxy-5-iodobenzoic acid has 1 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 3,4-Diethoxy-5-iodobenzoic acid?
The CAS number of 3,4-Diethoxy-5-iodobenzoic acid is 712294-47-8.
What is the molecular formula of 3,4-Diethoxy-5-iodobenzoic acid?
The molecular formula of 3,4-Diethoxy-5-iodobenzoic acid is C11H13IO4.
What is the molecular weight of 3,4-Diethoxy-5-iodobenzoic acid?
The molecular weight of 3,4-Diethoxy-5-iodobenzoic acid is 335.99 g/mol.
Where can I buy 3,4-Diethoxy-5-iodobenzoic acid?
You can request a quote for 3,4-Diethoxy-5-iodobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Diethoxy-5-iodobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Diethoxy-5-iodobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.