Titanium tributanolate
TL;DR: Titanium tributanolate (CAS 5058-41-3) is a chemical compound with molecular formula C12H27O3Ti and molecular weight 267.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(butan-1-olate);titanium(3+)
Also Known As: Titanium tributanolate, Tributyl titanate, titaniumtributanolate, EINECS 225-759-7, butan-1-olate,titanium(3+)
| Molecular Formula | C12H27O3Ti |
|---|---|
| Molecular Weight | 267.14 g/mol |
| LogP | 0.4379 |
| Topological Polar Surface Area | 69.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 267.14395 |
| Heavy Atoms | 16 |
| Complexity | 53.01955 |
Chemical Identifiers
| CAS Number | 5058-41-3 |
|---|---|
| SMILES | CCCC[O-].CCCC[O-].CCCC[O-].[Ti+3] |
Product Overview
Titanium tributanolate (CAS 5058-41-3), with molecular formula C12H27O3Ti and molecular weight 267.14 g/mol. IUPAC: tris(butan-1-olate);titanium(3+).
Chemical Property Profile of Titanium tributanolate
Property Insights of Titanium tributanolate
The XLogP value of 0.4379 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Titanium tributanolate. The TPSA of 69.18 Ų falls within the moderate polarity range, balancing permeability and solubility for Titanium tributanolate. Following Lipinski's Rule of Five, Titanium tributanolate has 0 hydrogen bond donor(s) and 3 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 tributanolate?
The CAS number of Titanium tributanolate is 5058-41-3.
What is the molecular formula of Titanium tributanolate?
The molecular formula of Titanium tributanolate is C12H27O3Ti.
What is the molecular weight of Titanium tributanolate?
The molecular weight of Titanium tributanolate is 267.14 g/mol.
Where can I buy Titanium tributanolate?
You can request a quote for Titanium tributanolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Titanium tributanolate?
Yes, KEHONG BIO provides custom synthesis services for Titanium tributanolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.