Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate
TL;DR: Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate (CAS 114185-65-8) 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.
ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate
Also Known As: ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate, Ethyl 5-(2-hydroxyethoxy)-2-iodo-benzoate
| Molecular Formula | C11H13IO4 |
|---|---|
| Molecular Weight | 335.99 g/mol |
| LogP | 1.839 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.98587 |
| Heavy Atoms | 16 |
| Complexity | 365.00223 |
Chemical Identifiers
| CAS Number | 114185-65-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=CC(=C1)OCCO)I |
Product Overview
Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate (CAS 114185-65-8), with molecular formula C11H13IO4 and molecular weight 335.99 g/mol. IUPAC: ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate.
Chemical Property Profile of Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate
Property Insights of Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate
The XLogP value of 1.839 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate. With a topological polar surface area (TPSA) of 55.76 Ų, Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate 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 Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate?
The CAS number of Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate is 114185-65-8.
What is the molecular formula of Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate?
The molecular formula of Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate is C11H13IO4.
What is the molecular weight of Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate?
The molecular weight of Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate is 335.99 g/mol.
Where can I buy Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate?
You can request a quote for Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-(2-hydroxyethoxy)-2-iodobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.