Perfluorooctanesulfonate
TL;DR: Perfluorooctanesulfonate (CAS 45298-90-6) is a chemical compound with molecular formula C8F17O3S- and molecular weight 498.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonate
Also Known As: Perfluorooctanesulfonate, Perfluorooctane sulfonate, Heptadecafluoro-1-octanesulfonate, Heptadecafluorooctane-1-sulfonate, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonate
| Molecular Formula | C8F17O3S- |
|---|---|
| Molecular Weight | 498.93 g/mol |
| LogP | 4.4985 |
| Topological Polar Surface Area | 57.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 498.92966 |
| Heavy Atoms | 29 |
| Complexity | 732.2672 |
Chemical Identifiers
| CAS Number | 45298-90-6 |
|---|---|
| SMILES | C(C(C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
Product Overview
Perfluorooctanesulfonate (CAS 45298-90-6), with molecular formula C8F17O3S- and molecular weight 498.93 g/mol. IUPAC: 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonate.
Chemical Property Profile of Perfluorooctanesulfonate
Property Insights of Perfluorooctanesulfonate
The XLogP value of 4.4985 indicates that Perfluorooctanesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.2 Ų, Perfluorooctanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Perfluorooctanesulfonate 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 Perfluorooctanesulfonate?
The CAS number of Perfluorooctanesulfonate is 45298-90-6.
What is the molecular formula of Perfluorooctanesulfonate?
The molecular formula of Perfluorooctanesulfonate is C8F17O3S-.
What is the molecular weight of Perfluorooctanesulfonate?
The molecular weight of Perfluorooctanesulfonate is 498.93 g/mol.
Where can I buy Perfluorooctanesulfonate?
You can request a quote for Perfluorooctanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perfluorooctanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Perfluorooctanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.