2-Ethylhexyl iodoacetate
TL;DR: 2-Ethylhexyl iodoacetate (CAS 6301-53-7) is a chemical compound with molecular formula C10H19IO2 and molecular weight 298.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylhexyl 2-iodoacetate
Also Known As: 2-ethylhexyl iodoacetate, 2-ethylhexyl 2-iodoacetate, Acetic acid, 2-iodo-,2-ethylhexyl ester
| Molecular Formula | C10H19IO2 |
|---|---|
| Molecular Weight | 298.04 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 298.04297 |
| Heavy Atoms | 13 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 6301-53-7 |
|---|---|
| SMILES | CCCCC(CC)COC(=O)CI |
| InChIKey | JMLJFGVZNJBROE-UHFFFAOYSA-N |
Product Overview
2-Ethylhexyl iodoacetate (CAS 6301-53-7), with molecular formula C10H19IO2 and molecular weight 298.04 g/mol. IUPAC: 2-ethylhexyl 2-iodoacetate.
Chemical Property Profile of 2-Ethylhexyl iodoacetate
Property Insights of 2-Ethylhexyl iodoacetate
The XLogP value of 3.9 indicates that 2-Ethylhexyl iodoacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Ethylhexyl iodoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylhexyl 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 2-Ethylhexyl iodoacetate?
The CAS number of 2-Ethylhexyl iodoacetate is 6301-53-7.
What is the molecular formula of 2-Ethylhexyl iodoacetate?
The molecular formula of 2-Ethylhexyl iodoacetate is C10H19IO2.
What is the molecular weight of 2-Ethylhexyl iodoacetate?
The molecular weight of 2-Ethylhexyl iodoacetate is 298.04 g/mol.
Where can I buy 2-Ethylhexyl iodoacetate?
You can request a quote for 2-Ethylhexyl iodoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylhexyl iodoacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylhexyl iodoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.