Barium trifluoromethanesulphonate
TL;DR: Barium trifluoromethanesulphonate (CAS 2794-60-7) is a chemical compound with molecular formula C2BaF6O6S2 and molecular weight 435.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
barium(2+);bis(trifluoromethanesulfonate)
Also Known As: Barium trifluoromethanesulfonate, Barium triflate, Triflic acid, Barium trifluoromethanesulphonate, C2BaF6O6S2
| Molecular Formula | C2BaF6O6S2 |
|---|---|
| Molecular Weight | 435.81 g/mol |
| LogP | -0.28 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 0 |
| Exact Mass | 435.8093 |
| Heavy Atoms | 17 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 2794-60-7 |
|---|---|
| SMILES | C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Ba+2] |
| InChIKey | DXJURUJRANOYMX-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Barium trifluoromethanesulphonate (CAS 2794-60-7), with molecular formula C2BaF6O6S2 and molecular weight 435.81 g/mol. IUPAC: barium(2+);bis(trifluoromethanesulfonate).
Chemical Property Profile of Barium trifluoromethanesulphonate
Property Insights of Barium trifluoromethanesulphonate
The XLogP value of -0.28 indicates that Barium trifluoromethanesulphonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Barium trifluoromethanesulphonate. Following Lipinski's Rule of Five, Barium trifluoromethanesulphonate has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Barium trifluoromethanesulphonate?
The CAS number of Barium trifluoromethanesulphonate is 2794-60-7.
What is the molecular formula of Barium trifluoromethanesulphonate?
The molecular formula of Barium trifluoromethanesulphonate is C2BaF6O6S2.
What is the molecular weight of Barium trifluoromethanesulphonate?
The molecular weight of Barium trifluoromethanesulphonate is 435.81 g/mol.
Where can I buy Barium trifluoromethanesulphonate?
You can request a quote for Barium trifluoromethanesulphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barium trifluoromethanesulphonate?
Yes, KEHONG BIO provides custom synthesis services for Barium trifluoromethanesulphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.