Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate
TL;DR: Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate (CAS 2558-75-0) is a chemical compound with molecular formula C12H10F17NO6S2 and molecular weight 650.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)amino]ethyl hydrogen sulfate
Also Known As: Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate, 1-Octanesulfonamide, N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-(2-(sulfooxy)ethyl)-, 1-Octanesulfonamide, N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-2-hydroxyethyl-, hydrogen sulfate, 1-(ethyl-(2-sulfooxyethyl)sulfamoyl)-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-octane, 2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)amino]ethyl hydrogen sulfate
| Molecular Formula | C12H10F17NO6S2 |
|---|---|
| Molecular Weight | 650.97 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 13 |
| Exact Mass | 650.96783 |
| Heavy Atoms | 38 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 2558-75-0 |
|---|---|
| SMILES | CCN(CCOS(=O)(=O)O)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | GUHKPYLZMQOFCA-UHFFFAOYSA-N |
Product Overview
Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate (CAS 2558-75-0), with molecular formula C12H10F17NO6S2 and molecular weight 650.97 g/mol. IUPAC: 2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)amino]ethyl hydrogen sulfate.
Chemical Property Profile of Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate
Property Insights of Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate
The XLogP value of 4.7 indicates that Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate. Following Lipinski's Rule of Five, Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate has 1 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate?
The CAS number of Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate is 2558-75-0.
What is the molecular formula of Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate?
The molecular formula of Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate is C12H10F17NO6S2.
What is the molecular weight of Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate?
The molecular weight of Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate is 650.97 g/mol.
Where can I buy Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate?
You can request a quote for Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate?
Yes, KEHONG BIO provides custom synthesis services for Mono(N-ethyl-2-perfluorooctylsulfonaminoethyl)hydrogen sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.