Barium hexafluoroacetylacetonate
TL;DR: Barium hexafluoroacetylacetonate (CAS 118131-57-0) is a chemical compound with molecular formula C10H2BaF12O4 and molecular weight 551.8814 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
barium(2+);bis((Z)-1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate)
Also Known As: Barium hexafluoroacetylacetonate, barium(2+);(Z)-1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate
Technical Specifications
| Molecular Formula | C10H2BaF12O4 |
| Molecular Weight | 551.8814 g/mol |
| XLogP | 1.4678 |
| Topological Polar Surface Area (TPSA) | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 2 |
| Exact Mass | 551.8814 Da |
| Heavy Atoms | 27 |
| Complexity | 210.0 |
| SMILES | C(=C(\[O-])/C(F)(F)F)\C(=O)C(F)(F)F.C(=C(\[O-])/C(F)(F)F)\C(=O)C(F)(F)F.[Ba+2] |
| InChIKey | WUXISMDFUAVWSS-PAMPIZDHSA-L |
Chemical Property Profile of Barium hexafluoroacetylacetonate
Property Insights of Barium hexafluoroacetylacetonate
The XLogP value of 1.4678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Barium hexafluoroacetylacetonate. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Barium hexafluoroacetylacetonate. Following Lipinski's Rule of Five, Barium hexafluoroacetylacetonate has 0 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Barium hexafluoroacetylacetonate?
The CAS number of Barium hexafluoroacetylacetonate is 118131-57-0.
What is the molecular formula of Barium hexafluoroacetylacetonate?
The molecular formula of Barium hexafluoroacetylacetonate is C10H2BaF12O4.
What is the molecular weight of Barium hexafluoroacetylacetonate?
The molecular weight of Barium hexafluoroacetylacetonate is 551.8814 g/mol.
Where can I buy Barium hexafluoroacetylacetonate?
You can request a quote for Barium hexafluoroacetylacetonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Barium hexafluoroacetylacetonate?
Yes, CoreyChem provides custom synthesis services for Barium hexafluoroacetylacetonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.