Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+)
TL;DR: Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+) (CAS 36870-02-7) is a chemical compound with molecular formula C13H20O6Ti and molecular weight 320.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+)
Also Known As: Bis-(pentane-2,4-dionato-o,o')(propane-1,3-diolato-o,o')titanium
| Molecular Formula | C13H20O6Ti |
|---|---|
| Molecular Weight | 320.07 g/mol |
| LogP | -2.2264 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.07394 |
| Heavy Atoms | 20 |
| Complexity | 103.0 |
Chemical Identifiers
| CAS Number | 36870-02-7 |
|---|---|
| SMILES | CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].C(C[O-])C[O-].[Ti+4] |
| InChIKey | MPJJRYGVHNTASI-UHFFFAOYSA-L |
Product Overview
Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+) (CAS 36870-02-7), with molecular formula C13H20O6Ti and molecular weight 320.07 g/mol. IUPAC: bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+).
Chemical Property Profile of Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+)
Property Insights of Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+)
The XLogP value of -2.2264 indicates that Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+). Following Lipinski's Rule of Five, Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+) has 0 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 Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+)?
The CAS number of Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+) is 36870-02-7.
What is the molecular formula of Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+)?
The molecular formula of Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+) is C13H20O6Ti.
What is the molecular weight of Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+)?
The molecular weight of Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+) is 320.07 g/mol.
Where can I buy Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+)?
You can request a quote for Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+)?
Yes, KEHONG BIO provides custom synthesis services for Bis(4-oxopent-2-en-2-olate);propane-1,3-diolate;titanium(4+) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.