Bis(isononanoato-O)oxozirconium
TL;DR: Bis(isononanoato-O)oxozirconium (CAS 97925-91-2) is a chemical compound with molecular formula C18H36O5Zr and molecular weight 422.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(7-methyloctanoic acid);oxozirconium
Also Known As: Bis(isononanoato-O)oxozirconium, EINECS 308-203-9
| Molecular Formula | C18H36O5Zr |
|---|---|
| Molecular Weight | 422.16 g/mol |
| LogP | 5.23 |
| Topological Polar Surface Area | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 422.16098 |
| Heavy Atoms | 24 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 97925-91-2 |
|---|---|
| SMILES | CC(C)CCCCCC(=O)O.CC(C)CCCCCC(=O)O.O=[Zr] |
| InChIKey | HEECNFSGWAXQKA-UHFFFAOYSA-N |
Product Overview
Bis(isononanoato-O)oxozirconium (CAS 97925-91-2), with molecular formula C18H36O5Zr and molecular weight 422.16 g/mol. IUPAC: bis(7-methyloctanoic acid);oxozirconium.
Chemical Property Profile of Bis(isononanoato-O)oxozirconium
Property Insights of Bis(isononanoato-O)oxozirconium
The XLogP value of 5.23 indicates that Bis(isononanoato-O)oxozirconium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(isononanoato-O)oxozirconium. Following Lipinski's Rule of Five, Bis(isononanoato-O)oxozirconium has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(isononanoato-O)oxozirconium?
The CAS number of Bis(isononanoato-O)oxozirconium is 97925-91-2.
What is the molecular formula of Bis(isononanoato-O)oxozirconium?
The molecular formula of Bis(isononanoato-O)oxozirconium is C18H36O5Zr.
What is the molecular weight of Bis(isononanoato-O)oxozirconium?
The molecular weight of Bis(isononanoato-O)oxozirconium is 422.16 g/mol.
Where can I buy Bis(isononanoato-O)oxozirconium?
You can request a quote for Bis(isononanoato-O)oxozirconium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(isononanoato-O)oxozirconium?
Yes, KEHONG BIO provides custom synthesis services for Bis(isononanoato-O)oxozirconium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.