鈦酸丁酯
TL;DR: 鈦酸丁酯 (CAS 5593-70-4) is a chemical compound with molecular formula C16H36O4Ti and molecular weight 340.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
鈦酸丁酯
tetrakis(butan-1-olate);titanium(4+)
Also Known As: Butyl titanate, Titanium tetrabutoxide, Titanium Butoxide, Titanium(IV) butoxide, TETRABUTYL TITANATE
| Molecular Formula | C16H36O4Ti |
|---|---|
| Molecular Weight | 340.21 g/mol |
| LogP | 0.58 |
| Topological Polar Surface Area | 92.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 340.2093 |
| Heavy Atoms | 21 |
| Complexity | 13.0 |
| Melting Point | -55.0 °C |
| Boiling Point | 311.7 °C at 760 mmHg |
| Density | 0.998 at 25.0 °C - Less dense than water; will float |
| Solubility | Sol in most organic solvents except ketones |
| Flash Point | 76.7 °C |
| Refractive Index | 1.486 |
Chemical Identifiers
| CAS Number | 5593-70-4 |
|---|---|
| SMILES | CCCC[O-].CCCC[O-].CCCC[O-].CCCC[O-].[Ti+4] |
| InChIKey | YHWCPXVTRSHPNY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
鈦酸丁酯 (CAS 5593-70-4), with molecular formula C16H36O4Ti and molecular weight 340.21 g/mol. IUPAC: tetrakis(butan-1-olate);titanium(4+).
Chemical Property Profile of 鈦酸丁酯
Property Insights of 鈦酸丁酯
The XLogP value of 0.58 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 鈦酸丁酯. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 鈦酸丁酯. Following Lipinski's Rule of Five, 鈦酸丁酯 has 0 hydrogen bond donor(s) and 4 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 鈦酸丁酯?
The CAS number of 鈦酸丁酯 is 5593-70-4.
What is the molecular formula of 鈦酸丁酯?
The molecular formula of 鈦酸丁酯 is C16H36O4Ti.
What is the molecular weight of 鈦酸丁酯?
The molecular weight of 鈦酸丁酯 is 340.21 g/mol.
Where can I buy 鈦酸丁酯?
You can request a quote for 鈦酸丁酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 鈦酸丁酯?
Yes, KEHONG BIO provides custom synthesis services for 鈦酸丁酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.