Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1)
TL;DR: Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1) (CAS 73892-04-3) is a chemical compound with molecular formula C17H38O6Ti and molecular weight 386.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethylpropanoic acid;tetrakis(propan-2-olate);titanium(4+)
Also Known As: C5H10O2.C3H8O.1/4Ti, C5-H10-O2.C3-H8-O.1/4Ti, Titanium tetraisopropylate, neopentanoic acid reaction product, Propanoic acid, 2,2-dimethyl-, reaction products with iso-Pr alc. titanium(4+) salt, 2,2-dimethylpropanoic acid; propan-2-olate; titanium(4+)
| Molecular Formula | C17H38O6Ti |
|---|---|
| Molecular Weight | 386.21 g/mol |
| LogP | 0.135 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 386.21478 |
| Heavy Atoms | 24 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 73892-04-3 |
|---|---|
| SMILES | CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)(C)C(=O)O.[Ti+4] |
| InChIKey | JUBQMDJDNPOMMJ-UHFFFAOYSA-N |
Product Overview
Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1) (CAS 73892-04-3), with molecular formula C17H38O6Ti and molecular weight 386.21 g/mol. IUPAC: 2,2-dimethylpropanoic acid;tetrakis(propan-2-olate);titanium(4+).
Chemical Property Profile of Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1)
Property Insights of Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1)
The XLogP value of 0.135 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1). The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1). Following Lipinski's Rule of Five, Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1) has 1 hydrogen bond donor(s) and 6 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+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1)?
The CAS number of Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1) is 73892-04-3.
What is the molecular formula of Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1)?
The molecular formula of Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1) is C17H38O6Ti.
What is the molecular weight of Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1)?
The molecular weight of Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1) is 386.21 g/mol.
Where can I buy Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1)?
You can request a quote for Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1)?
Yes, KEHONG BIO provides custom synthesis services for Titanium(4+) propan-2-olate--2,2-dimethylpropanoic acid (1/4/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.