Catechol Bis(trifluoromethanesulfonate)
TL;DR: Catechol Bis(trifluoromethanesulfonate) (CAS 17763-91-6) is a chemical compound with molecular formula C8H4F6O6S2 and molecular weight 373.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(trifluoromethylsulfonyloxy)phenyl] trifluoromethanesulfonate
Also Known As: Catechol bis(trifluoromethanesulfonate), Catechol Ditriflate, CatecholBis(trifluoromethanesulfonate), 1,2-bis(trifluoromethylsulfonyloxy)benzene, phenylene bis(trifluoromethanesulfonate)
| Molecular Formula | C8H4F6O6S2 |
|---|---|
| Molecular Weight | 373.94 g/mol |
| LogP | 2.1434 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.93536 |
| Heavy Atoms | 22 |
| Complexity | 683.0663 |
Chemical Identifiers
| CAS Number | 17763-91-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F |
Product Overview
Catechol Bis(trifluoromethanesulfonate) (CAS 17763-91-6), with molecular formula C8H4F6O6S2 and molecular weight 373.94 g/mol. IUPAC: [2-(trifluoromethylsulfonyloxy)phenyl] trifluoromethanesulfonate.
Chemical Property Profile of Catechol Bis(trifluoromethanesulfonate)
Property Insights of Catechol Bis(trifluoromethanesulfonate)
The XLogP value of 2.1434 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Catechol Bis(trifluoromethanesulfonate). The TPSA of 86.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Catechol Bis(trifluoromethanesulfonate). Following Lipinski's Rule of Five, Catechol Bis(trifluoromethanesulfonate) has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Catechol Bis(trifluoromethanesulfonate)?
The CAS number of Catechol Bis(trifluoromethanesulfonate) is 17763-91-6.
What is the molecular formula of Catechol Bis(trifluoromethanesulfonate)?
The molecular formula of Catechol Bis(trifluoromethanesulfonate) is C8H4F6O6S2.
What is the molecular weight of Catechol Bis(trifluoromethanesulfonate)?
The molecular weight of Catechol Bis(trifluoromethanesulfonate) is 373.94 g/mol.
Where can I buy Catechol Bis(trifluoromethanesulfonate)?
You can request a quote for Catechol Bis(trifluoromethanesulfonate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Catechol Bis(trifluoromethanesulfonate)?
Yes, KEHONG BIO provides custom synthesis services for Catechol Bis(trifluoromethanesulfonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.