Thallium(1+);1,1,1-trifluoropentane-2,4-dione
TL;DR: Thallium(1+);1,1,1-trifluoropentane-2,4-dione (CAS 54412-40-7) is a chemical compound with molecular formula C5H4F3O2Tl and molecular weight 357.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
thallium(1+);1,1,1-trifluoropentane-2,4-dione
Also Known As: Thallium(I) trifluoroacetylacetonate, IUPAC: Thallium(+1) Cation; 1,1,1-trifluoropentane-2,4-dione
| Molecular Formula | C5H4F3O2Tl |
|---|---|
| Molecular Weight | 357.99 g/mol |
| LogP | 0.53029 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 357.99078 |
| Heavy Atoms | 11 |
| Complexity | 163.6007 |
Chemical Identifiers
| CAS Number | 54412-40-7 |
|---|---|
| SMILES | CC(=O)[CH-]C(=O)C(F)(F)F.[Tl+] |
Product Overview
Thallium(1+);1,1,1-trifluoropentane-2,4-dione (CAS 54412-40-7), with molecular formula C5H4F3O2Tl and molecular weight 357.99 g/mol. IUPAC: thallium(1+);1,1,1-trifluoropentane-2,4-dione.
Chemical Property Profile of Thallium(1+);1,1,1-trifluoropentane-2,4-dione
Property Insights of Thallium(1+);1,1,1-trifluoropentane-2,4-dione
The XLogP value of 0.53029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thallium(1+);1,1,1-trifluoropentane-2,4-dione. With a topological polar surface area (TPSA) of 34.14 Ų, Thallium(1+);1,1,1-trifluoropentane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thallium(1+);1,1,1-trifluoropentane-2,4-dione has 0 hydrogen bond donor(s) and 2 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 Thallium(1+);1,1,1-trifluoropentane-2,4-dione?
The CAS number of Thallium(1+);1,1,1-trifluoropentane-2,4-dione is 54412-40-7.
What is the molecular formula of Thallium(1+);1,1,1-trifluoropentane-2,4-dione?
The molecular formula of Thallium(1+);1,1,1-trifluoropentane-2,4-dione is C5H4F3O2Tl.
What is the molecular weight of Thallium(1+);1,1,1-trifluoropentane-2,4-dione?
The molecular weight of Thallium(1+);1,1,1-trifluoropentane-2,4-dione is 357.99 g/mol.
Where can I buy Thallium(1+);1,1,1-trifluoropentane-2,4-dione?
You can request a quote for Thallium(1+);1,1,1-trifluoropentane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thallium(1+);1,1,1-trifluoropentane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for Thallium(1+);1,1,1-trifluoropentane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.