乙酰丙酮锆
TL;DR: 乙酰丙酮锆 (CAS 17501-44-9) is a chemical compound with molecular formula C20H28O8Zr and molecular weight 486.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙酰丙酮锆
tetrakis(4-oxopent-2-en-2-olate);zirconium(4+)
Also Known As: Zirconium acetylacetonate, 4-oxopent-2-en-2-olate;zirconium(4+), Tetrakis(2,4-pentanedionato)zirconium(IV), Zirconium(4+) tetrakis[(2Z)-4-oxo-2-penten-2-olate], zirconium(4+) tris(4-oxopent-2-en-2-olate) acetylacetonate
| Molecular Formula | C20H28O8Zr |
|---|---|
| Molecular Weight | 486.08 g/mol |
| LogP | -0.64 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.08313 |
| Heavy Atoms | 29 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 17501-44-9 |
|---|---|
| SMILES | CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Zr+4] |
| InChIKey | FPFOSIXCIBGKOH-UHFFFAOYSA-J |
Product Overview
乙酰丙酮锆 (CAS 17501-44-9), with molecular formula C20H28O8Zr and molecular weight 486.08 g/mol. IUPAC: tetrakis(4-oxopent-2-en-2-olate);zirconium(4+).
Chemical Property Profile of 乙酰丙酮锆
Property Insights of 乙酰丙酮锆
The XLogP value of -0.64 indicates that 乙酰丙酮锆 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting 乙酰丙酮锆 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 乙酰丙酮锆 has 0 hydrogen bond donor(s) and 8 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 乙酰丙酮锆?
The CAS number of 乙酰丙酮锆 is 17501-44-9.
What is the molecular formula of 乙酰丙酮锆?
The molecular formula of 乙酰丙酮锆 is C20H28O8Zr.
What is the molecular weight of 乙酰丙酮锆?
The molecular weight of 乙酰丙酮锆 is 486.08 g/mol.
Where can I buy 乙酰丙酮锆?
You can request a quote for 乙酰丙酮锆 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙酰丙酮锆?
Yes, KEHONG BIO provides custom synthesis services for 乙酰丙酮锆 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.