Ethyl fluoroiodoacetate
TL;DR: Ethyl fluoroiodoacetate (CAS 220227-66-7) is a chemical compound with molecular formula C4H6FIO2 and molecular weight 231.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-fluoro-2-iodoacetate
Also Known As: Ethyl iodofluoroacetate, ethyl 2-fluoro-2-iodoacetate, Ethyl fluoroiodoacetate, Ethyl fluoro(iodo)acetate, Fluoroiodoacetic acid ethyl ester
| Molecular Formula | C4H6FIO2 |
|---|---|
| Molecular Weight | 231.94 g/mol |
| LogP | 1.2801 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.93967 |
| Heavy Atoms | 8 |
| Complexity | 84.1075 |
Chemical Identifiers
| CAS Number | 220227-66-7 |
|---|---|
| SMILES | CCOC(=O)C(F)I |
Product Overview
Ethyl fluoroiodoacetate (CAS 220227-66-7), with molecular formula C4H6FIO2 and molecular weight 231.94 g/mol. IUPAC: ethyl 2-fluoro-2-iodoacetate.
Chemical Property Profile of Ethyl fluoroiodoacetate
Property Insights of Ethyl fluoroiodoacetate
The XLogP value of 1.2801 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl fluoroiodoacetate. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl fluoroiodoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl fluoroiodoacetate has 0 hydrogen bond donor(s) and 2 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 fluoroiodoacetate?
The CAS number of Ethyl fluoroiodoacetate is 220227-66-7.
What is the molecular formula of Ethyl fluoroiodoacetate?
The molecular formula of Ethyl fluoroiodoacetate is C4H6FIO2.
What is the molecular weight of Ethyl fluoroiodoacetate?
The molecular weight of Ethyl fluoroiodoacetate is 231.94 g/mol.
Where can I buy Ethyl fluoroiodoacetate?
You can request a quote for Ethyl fluoroiodoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl fluoroiodoacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl fluoroiodoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.