Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate
TL;DR: Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate (CAS 84563-54-2) is a chemical compound with molecular formula C21H26F3IO3S and molecular weight 542.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(4-tert-butylphenyl)iodanium;trifluoromethanesulfonate
Also Known As: Bis(4-tert-butylphenyl)iodonium triflate, DtBPIT, Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate, 1-BROMOHEPTADECANE, Bis(4-(tert-butyl)phenyl)iodonium trifluoromethanesulfonate
| Molecular Formula | C21H26F3IO3S |
|---|---|
| Molecular Weight | 542.06 g/mol |
| LogP | 2.4614 |
| Topological Polar Surface Area | 57.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 542.05994 |
| Heavy Atoms | 29 |
| Complexity | 835.1631 |
Chemical Identifiers
| CAS Number | 84563-54-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-] |
Product Overview
Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate (CAS 84563-54-2), with molecular formula C21H26F3IO3S and molecular weight 542.06 g/mol. IUPAC: bis(4-tert-butylphenyl)iodanium;trifluoromethanesulfonate.
Chemical Property Profile of Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate
Property Insights of Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate
The XLogP value of 2.4614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate. With a topological polar surface area (TPSA) of 57.2 Ų, Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate?
The CAS number of Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate is 84563-54-2.
What is the molecular formula of Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate?
The molecular formula of Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate is C21H26F3IO3S.
What is the molecular weight of Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate?
The molecular weight of Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate is 542.06 g/mol.
Where can I buy Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate?
You can request a quote for Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.