Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2)
TL;DR: Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2) (CAS 20753-28-0) is a chemical compound with molecular formula C20H36O8Ti and molecular weight 452.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(butan-1-olate);bis(4-ethoxy-4-oxobut-2-en-2-olate);titanium(4+)
Also Known As: Titanium, dibutoxybis[ethyl 3-(oxo-.kappa.O)butanoato-.kappa.O']-, Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2)
| Molecular Formula | C20H36O8Ti |
|---|---|
| Molecular Weight | 452.19 g/mol |
| LogP | -0.08 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 452.18896 |
| Heavy Atoms | 29 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 20753-28-0 |
|---|---|
| SMILES | CCCC[O-].CCCC[O-].CCOC(=O)C=C(C)[O-].CCOC(=O)C=C(C)[O-].[Ti+4] |
| InChIKey | LOKYMTAHMJKNDB-UHFFFAOYSA-L |
Product Overview
Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2) (CAS 20753-28-0), with molecular formula C20H36O8Ti and molecular weight 452.19 g/mol. IUPAC: bis(butan-1-olate);bis(4-ethoxy-4-oxobut-2-en-2-olate);titanium(4+).
Chemical Property Profile of Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2)
Property Insights of Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2)
The XLogP value of -0.08 indicates that Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 145.0 Ų indicates high polarity, suggesting Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2) 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 Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2)?
The CAS number of Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2) is 20753-28-0.
What is the molecular formula of Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2)?
The molecular formula of Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2) is C20H36O8Ti.
What is the molecular weight of Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2)?
The molecular weight of Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2) is 452.19 g/mol.
Where can I buy Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2)?
You can request a quote for Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2)?
Yes, KEHONG BIO provides custom synthesis services for Titanium(4+) butan-1-olate 4-ethoxy-4-oxobut-2-en-2-olate (1/2/2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.