1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate
TL;DR: 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate (CAS 156241-41-7) is a chemical compound with molecular formula C4HF9O3S and molecular weight 299.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,3,3,3-hexafluoropropan-2-yl trifluoromethanesulfonate
Also Known As: HEXAFLUOROISOPROPYL TRIFLUOROMETHANESULFONATE, C4HF9O3S, 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate, 1,1,1,3,3,3-hexafluoropropan-2-yl trifluoromethanesulfonate, HEXAFLUOROISOPROPYLTRIFLUOROMETHANESULFONATE
| Molecular Formula | C4HF9O3S |
|---|---|
| Molecular Weight | 299.95 g/mol |
| LogP | 2.3458 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.95026 |
| Heavy Atoms | 17 |
| Complexity | 345.17288 |
Chemical Identifiers
| CAS Number | 156241-41-7 |
|---|---|
| SMILES | C(C(F)(F)F)(C(F)(F)F)OS(=O)(=O)C(F)(F)F |
Product Overview
1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate (CAS 156241-41-7), with molecular formula C4HF9O3S and molecular weight 299.95 g/mol. IUPAC: 1,1,1,3,3,3-hexafluoropropan-2-yl trifluoromethanesulfonate.
Chemical Property Profile of 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate
Property Insights of 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate
The XLogP value of 2.3458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate. With a topological polar surface area (TPSA) of 43.37 Ų, 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate has 0 hydrogen bond donor(s) and 3 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 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate?
The CAS number of 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate is 156241-41-7.
What is the molecular formula of 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate?
The molecular formula of 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate is C4HF9O3S.
What is the molecular weight of 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate?
The molecular weight of 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate is 299.95 g/mol.
Where can I buy 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate?
You can request a quote for 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,3,3,3-Hexafluoroisopropyl Trifluoromethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.