Perfluorophenyl methanesulfonate
TL;DR: Perfluorophenyl methanesulfonate (CAS 161912-36-3) is a chemical compound with molecular formula C7H3F5O3S and molecular weight 261.97232 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,3,4,5,6-pentafluorophenyl) methanesulfonate
Also Known As: Perfluorophenyl methanesulfonate, 2,3,4,5,6-Pentafluorophenyl methanesulfonate, pentafluorophenyl methanesulfonate, Pentafluorophenyl methanesulphonate, Perfluorophenylmethanesulfonate
Technical Specifications
| Molecular Formula | C7H3F5O3S |
| Molecular Weight | 261.97232 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.97232 Da |
| Heavy Atoms | 16 |
| Complexity | 326.0 |
| SMILES | CS(=O)(=O)OC1=C(C(=C(C(=C1F)F)F)F)F |
| InChIKey | ARSIBVWMPYUPQT-UHFFFAOYSA-N |
Chemical Property Profile of Perfluorophenyl methanesulfonate
Property Insights of Perfluorophenyl methanesulfonate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Perfluorophenyl methanesulfonate. With a topological polar surface area (TPSA) of 51.8 Ų, Perfluorophenyl methanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Perfluorophenyl methanesulfonate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Perfluorophenyl methanesulfonate?
The CAS number of Perfluorophenyl methanesulfonate is 161912-36-3.
What is the molecular formula of Perfluorophenyl methanesulfonate?
The molecular formula of Perfluorophenyl methanesulfonate is C7H3F5O3S.
What is the molecular weight of Perfluorophenyl methanesulfonate?
The molecular weight of Perfluorophenyl methanesulfonate is 261.97232 g/mol.
Where can I buy Perfluorophenyl methanesulfonate?
You can request a quote for Perfluorophenyl methanesulfonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Perfluorophenyl methanesulfonate?
Yes, CoreyChem provides custom synthesis services for Perfluorophenyl methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.