Zirconium 2-ethylhexanoate
TL;DR: Zirconium 2-ethylhexanoate (CAS 18312-04-4) is a chemical compound with molecular formula C32H60O8Zr and molecular weight 662.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrakis(2-ethylhexanoate);zirconium(4+)
Also Known As: Zirconium 2-ethylhexanoate, Zirconium octoate, Zirconium tetra(2-ethylhexanoate), zirconium(iv) 2-ethylhexanoate, 2-ethylhexanoate;zirconium(4+)
| Molecular Formula | C32H60O8Zr |
|---|---|
| Molecular Weight | 662.33 g/mol |
| LogP | 3.8083 |
| Topological Polar Surface Area | 160.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Exact Mass | 662.3335 |
| Heavy Atoms | 41 |
| Complexity | 508.50537 |
Chemical Identifiers
| CAS Number | 18312-04-4 |
|---|---|
| SMILES | CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Zr+4] |
Product Overview
Zirconium 2-ethylhexanoate (CAS 18312-04-4), with molecular formula C32H60O8Zr and molecular weight 662.33 g/mol. IUPAC: tetrakis(2-ethylhexanoate);zirconium(4+).
Chemical Property Profile of Zirconium 2-ethylhexanoate
Property Insights of Zirconium 2-ethylhexanoate
The XLogP value of 3.8083 indicates that Zirconium 2-ethylhexanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 160.52 Ų indicates high polarity, suggesting Zirconium 2-ethylhexanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Zirconium 2-ethylhexanoate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Zirconium 2-ethylhexanoate?
The CAS number of Zirconium 2-ethylhexanoate is 18312-04-4.
What is the molecular formula of Zirconium 2-ethylhexanoate?
The molecular formula of Zirconium 2-ethylhexanoate is C32H60O8Zr.
What is the molecular weight of Zirconium 2-ethylhexanoate?
The molecular weight of Zirconium 2-ethylhexanoate is 662.33 g/mol.
Where can I buy Zirconium 2-ethylhexanoate?
You can request a quote for Zirconium 2-ethylhexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Zirconium 2-ethylhexanoate?
Yes, KEHONG BIO provides custom synthesis services for Zirconium 2-ethylhexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.