Trifluoromethyl trifluoromethanesulfonate
TL;DR: Trifluoromethyl trifluoromethanesulfonate (CAS 3582-05-6) is a chemical compound with molecular formula C2F6O3S and molecular weight 217.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trifluoromethyl trifluoromethanesulfonate
Also Known As: trifluoromethyl trifluoromethanesulfonate, trifluoromethyl triflate, fluoromethyl triflate, Trifluoromethyltriflate, Trifluormethyl triflate
| Molecular Formula | C2F6O3S |
|---|---|
| Molecular Weight | 217.95 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.94724 |
| Heavy Atoms | 12 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 3582-05-6 |
|---|---|
| SMILES | C(OS(=O)(=O)C(F)(F)F)(F)(F)F |
| InChIKey | GVZFDPPAJXHNGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trifluoromethyl trifluoromethanesulfonate (CAS 3582-05-6), with molecular formula C2F6O3S and molecular weight 217.95 g/mol. IUPAC: trifluoromethyl trifluoromethanesulfonate.
Chemical Property Profile of Trifluoromethyl trifluoromethanesulfonate
Property Insights of Trifluoromethyl trifluoromethanesulfonate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trifluoromethyl trifluoromethanesulfonate. With a topological polar surface area (TPSA) of 51.8 Ų, Trifluoromethyl trifluoromethanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trifluoromethyl trifluoromethanesulfonate has 0 hydrogen bond donor(s) and 9 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 Trifluoromethyl trifluoromethanesulfonate?
The CAS number of Trifluoromethyl trifluoromethanesulfonate is 3582-05-6.
What is the molecular formula of Trifluoromethyl trifluoromethanesulfonate?
The molecular formula of Trifluoromethyl trifluoromethanesulfonate is C2F6O3S.
What is the molecular weight of Trifluoromethyl trifluoromethanesulfonate?
The molecular weight of Trifluoromethyl trifluoromethanesulfonate is 217.95 g/mol.
Where can I buy Trifluoromethyl trifluoromethanesulfonate?
You can request a quote for Trifluoromethyl trifluoromethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trifluoromethyl trifluoromethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Trifluoromethyl trifluoromethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.