Ethyl iodoacetate
TL;DR: Ethyl iodoacetate (CAS 623-48-3) is a chemical compound with molecular formula C4H7IO2 and molecular weight 213.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-iodoacetate
Also Known As: ETHYL IODOACETATE, ethyl 2-iodoacetate, Ethyl monoiodoacetate, ethyliodoacetate, Acetic acid, iodo-, ethyl ester
| Molecular Formula | C4H7IO2 |
|---|---|
| Molecular Weight | 213.95 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.94908 |
| Heavy Atoms | 7 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 623-48-3 |
|---|---|
| SMILES | CCOC(=O)CI |
| InChIKey | MFFXVVHUKRKXCI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl iodoacetate (CAS 623-48-3), with molecular formula C4H7IO2 and molecular weight 213.95 g/mol. IUPAC: ethyl 2-iodoacetate.
Chemical Property Profile of Ethyl iodoacetate
Property Insights of Ethyl iodoacetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl iodoacetate. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl iodoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl iodoacetate 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 iodoacetate?
The CAS number of Ethyl iodoacetate is 623-48-3.
What is the molecular formula of Ethyl iodoacetate?
The molecular formula of Ethyl iodoacetate is C4H7IO2.
What is the molecular weight of Ethyl iodoacetate?
The molecular weight of Ethyl iodoacetate is 213.95 g/mol.
Where can I buy Ethyl iodoacetate?
You can request a quote for Ethyl iodoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl iodoacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl iodoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.