乙酰丙酮钛(IV)
TL;DR: 乙酰丙酮钛(IV) (CAS 17501-79-0) is a chemical compound with molecular formula C20H28O8Ti and molecular weight 444.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙酰丙酮钛(IV)
tetrakis(4-oxopent-2-en-2-olate);titanium(4+)
Also Known As: Titanium tetraacetylacetonate, pentane-2,4-dione;titanium(4+), 4-oxopent-2-en-2-olate;titanium(4+), Tetrakis(pentane-2,4-dionato-O,O')titanium, Tetrakis(2,4-pentanedionato)titanium(IV) (ca. 63% in Isopropyl Alcohol)
| Molecular Formula | C20H28O8Ti |
|---|---|
| Molecular Weight | 444.13 g/mol |
| LogP | -0.6445 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.12637 |
| Heavy Atoms | 29 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 17501-79-0 |
|---|---|
| SMILES | CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Ti+4] |
| InChIKey | TYKCBTYOMAUNLH-UHFFFAOYSA-J |
Product Overview
乙酰丙酮钛(IV) (CAS 17501-79-0), with molecular formula C20H28O8Ti and molecular weight 444.13 g/mol. IUPAC: tetrakis(4-oxopent-2-en-2-olate);titanium(4+).
Chemical Property Profile of 乙酰丙酮钛(IV)
Property Insights of 乙酰丙酮钛(IV)
The XLogP value of -0.6445 indicates that 乙酰丙酮钛(IV) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting 乙酰丙酮钛(IV) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 乙酰丙酮钛(IV) 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 乙酰丙酮钛(IV)?
The CAS number of 乙酰丙酮钛(IV) is 17501-79-0.
What is the molecular formula of 乙酰丙酮钛(IV)?
The molecular formula of 乙酰丙酮钛(IV) is C20H28O8Ti.
What is the molecular weight of 乙酰丙酮钛(IV)?
The molecular weight of 乙酰丙酮钛(IV) is 444.13 g/mol.
Where can I buy 乙酰丙酮钛(IV)?
You can request a quote for 乙酰丙酮钛(IV) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙酰丙酮钛(IV)?
Yes, KEHONG BIO provides custom synthesis services for 乙酰丙酮钛(IV) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.