Tris(trifluoroacetato-O)iodine
TL;DR: Tris(trifluoroacetato-O)iodine (CAS 14353-86-7) is a chemical compound with molecular formula C6F9IO6 and molecular weight 465.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[bis[(2,2,2-trifluoroacetyl)oxy]-λ3-iodanyl] 2,2,2-trifluoroacetate
Also Known As: Tris(trifluoroacetato-O)iodine, Tris(trifluoroacetoxy)iodine, Iodine(III) Trifluoracetate, iodine tris(trifluoroacetate), tris[(trifluoroacetyl)oxy]-
| Molecular Formula | C6F9IO6 |
|---|---|
| Molecular Weight | 465.86 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 6 |
| Exact Mass | 465.8596 |
| Heavy Atoms | 22 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 14353-86-7 |
|---|---|
| SMILES | C(=O)(C(F)(F)F)OI(OC(=O)C(F)(F)F)OC(=O)C(F)(F)F |
| InChIKey | LLKSJVKRWAPXNE-UHFFFAOYSA-N |
Product Overview
Tris(trifluoroacetato-O)iodine (CAS 14353-86-7), with molecular formula C6F9IO6 and molecular weight 465.86 g/mol. IUPAC: [bis[(2,2,2-trifluoroacetyl)oxy]-λ3-iodanyl] 2,2,2-trifluoroacetate.
Chemical Property Profile of Tris(trifluoroacetato-O)iodine
Property Insights of Tris(trifluoroacetato-O)iodine
The XLogP value of 4.5 indicates that Tris(trifluoroacetato-O)iodine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Tris(trifluoroacetato-O)iodine. Following Lipinski's Rule of Five, Tris(trifluoroacetato-O)iodine has 0 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tris(trifluoroacetato-O)iodine?
The CAS number of Tris(trifluoroacetato-O)iodine is 14353-86-7.
What is the molecular formula of Tris(trifluoroacetato-O)iodine?
The molecular formula of Tris(trifluoroacetato-O)iodine is C6F9IO6.
What is the molecular weight of Tris(trifluoroacetato-O)iodine?
The molecular weight of Tris(trifluoroacetato-O)iodine is 465.86 g/mol.
Where can I buy Tris(trifluoroacetato-O)iodine?
You can request a quote for Tris(trifluoroacetato-O)iodine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tris(trifluoroacetato-O)iodine?
Yes, KEHONG BIO provides custom synthesis services for Tris(trifluoroacetato-O)iodine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.