Diphenyl(4-methoxyphenyl)sulphonium triflate
TL;DR: Diphenyl(4-methoxyphenyl)sulphonium triflate (CAS 116808-67-4) is a chemical compound with molecular formula C20H17F3O4S2 and molecular weight 442.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4-methoxyphenyl)-diphenyl-λ4-sulfanyl] trifluoromethanesulfonate
Also Known As: [(4-methoxyphenyl)-diphenyl-|Diphenyl(4-methoxyphenyl)sulphonium triflate|(4-methoxyphenyl)diphenyl-$l^{4}-sulfanyl trifluoromethanesulfonate|[(4-Methoxyphenyl)-diphenyl-lambda4-sulfanyl] trifluoromethanesulfonate|RXDHZQBHDPDICO-UHFFFAOYSA-N
| Molecular Formula | C20H17F3O4S2 |
|---|---|
| Molecular Weight | 442.05 g/mol |
| LogP | 5.7581 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.05203 |
| Heavy Atoms | 29 |
| Complexity | 1012.89026 |
Chemical Identifiers
| CAS Number | 116808-67-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)S(C2=CC=CC=C2)(C3=CC=CC=C3)OS(=O)(=O)C(F)(F)F |
Product Overview
Diphenyl(4-methoxyphenyl)sulphonium triflate (CAS 116808-67-4), with molecular formula C20H17F3O4S2 and molecular weight 442.05 g/mol. IUPAC: [(4-methoxyphenyl)-diphenyl-λ4-sulfanyl] trifluoromethanesulfonate.
Chemical Property Profile of Diphenyl(4-methoxyphenyl)sulphonium triflate
Property Insights of Diphenyl(4-methoxyphenyl)sulphonium triflate
The XLogP value of 5.7581 indicates that Diphenyl(4-methoxyphenyl)sulphonium triflate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Diphenyl(4-methoxyphenyl)sulphonium triflate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenyl(4-methoxyphenyl)sulphonium triflate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diphenyl(4-methoxyphenyl)sulphonium triflate?
The CAS number of Diphenyl(4-methoxyphenyl)sulphonium triflate is 116808-67-4.
What is the molecular formula of Diphenyl(4-methoxyphenyl)sulphonium triflate?
The molecular formula of Diphenyl(4-methoxyphenyl)sulphonium triflate is C20H17F3O4S2.
What is the molecular weight of Diphenyl(4-methoxyphenyl)sulphonium triflate?
The molecular weight of Diphenyl(4-methoxyphenyl)sulphonium triflate is 442.05 g/mol.
Where can I buy Diphenyl(4-methoxyphenyl)sulphonium triflate?
You can request a quote for Diphenyl(4-methoxyphenyl)sulphonium triflate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diphenyl(4-methoxyphenyl)sulphonium triflate?
Yes, KEHONG BIO provides custom synthesis services for Diphenyl(4-methoxyphenyl)sulphonium triflate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.