2,2,2-三氟乙基三氟甲磺酸酯
TL;DR: 2,2,2-三氟乙基三氟甲磺酸酯 (CAS 6226-25-1) is a chemical compound with molecular formula C3H2F6O3S and molecular weight 231.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-三氟乙基三氟甲磺酸酯
2,2,2-trifluoroethyl trifluoromethanesulfonate
Also Known As: 2,2,2-Trifluoroethyl trifluoromethanesulfonate, 2,2,2-Trifluoroethyl triflate, 2,2,2-Trifluoroethyltrifluoromethanesulfonate, Trifluoroethyltriflate, trifluoroethyl triflate
| Molecular Formula | C3H2F6O3S |
|---|---|
| Molecular Weight | 231.96 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.96289 |
| Heavy Atoms | 13 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 6226-25-1 |
|---|---|
| SMILES | C(C(F)(F)F)OS(=O)(=O)C(F)(F)F |
| InChIKey | RTMMSCJWQYWMNK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2,2-三氟乙基三氟甲磺酸酯 (CAS 6226-25-1), with molecular formula C3H2F6O3S and molecular weight 231.96 g/mol. IUPAC: 2,2,2-trifluoroethyl trifluoromethanesulfonate.
Chemical Property Profile of 2,2,2-三氟乙基三氟甲磺酸酯
Property Insights of 2,2,2-三氟乙基三氟甲磺酸酯
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-三氟乙基三氟甲磺酸酯. With a topological polar surface area (TPSA) of 51.8 Ų, 2,2,2-三氟乙基三氟甲磺酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,2-三氟乙基三氟甲磺酸酯 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 2,2,2-三氟乙基三氟甲磺酸酯?
The CAS number of 2,2,2-三氟乙基三氟甲磺酸酯 is 6226-25-1.
What is the molecular formula of 2,2,2-三氟乙基三氟甲磺酸酯?
The molecular formula of 2,2,2-三氟乙基三氟甲磺酸酯 is C3H2F6O3S.
What is the molecular weight of 2,2,2-三氟乙基三氟甲磺酸酯?
The molecular weight of 2,2,2-三氟乙基三氟甲磺酸酯 is 231.96 g/mol.
Where can I buy 2,2,2-三氟乙基三氟甲磺酸酯?
You can request a quote for 2,2,2-三氟乙基三氟甲磺酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-三氟乙基三氟甲磺酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-三氟乙基三氟甲磺酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.